Organoheterocyclic compounds
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1-Acetylpiperidine 98.0+%, TCI America™
CAS: 618-42-8 Molecular Formula: C7H13NO Molecular Weight (g/mol): 127.187 MDL Number: MFCD00006486 InChI Key: KDISMIMTGUMORD-UHFFFAOYSA-N PubChem CID: 12058 ChEBI: CHEBI:36591 IUPAC Name: 1-piperidin-1-ylethanone SMILES: CC(=O)N1CCCCC1
| PubChem CID | 12058 |
|---|---|
| CAS | 618-42-8 |
| Molecular Weight (g/mol) | 127.187 |
| ChEBI | CHEBI:36591 |
| MDL Number | MFCD00006486 |
| SMILES | CC(=O)N1CCCCC1 |
| IUPAC Name | 1-piperidin-1-ylethanone |
| InChI Key | KDISMIMTGUMORD-UHFFFAOYSA-N |
| Molecular Formula | C7H13NO |
1-Benzyl-4-piperidinecarboxaldehyde 96.0+%, TCI America™
CAS: 22065-85-6 Molecular Formula: C13H17NO Molecular Weight (g/mol): 203.285 MDL Number: MFCD02258902 InChI Key: SGIBOXBBPQRZDM-UHFFFAOYSA-N Synonym: 1-benzyl-4-piperidinecarboxaldehyde,n-benzylpiperidine-4-carboxaldehyde,1-benzyl-4-formylpiperidine,1-benzylpiperidine-4-carboxaldehyde,1-benzy-4-piperidine carboxyaldehyde,1-benzyl-4-piperidinecarbaldehyde,1-benzyl-piperidine-4-carbaldehyde,n-benzyl piperidine-4-carboxaldehyde,4-piperidinecarboxaldehyde, 1-phenylmethyl,n-benzyl-4-formylpiperidine PubChem CID: 89584 IUPAC Name: 1-benzylpiperidine-4-carbaldehyde SMILES: C1CN(CCC1C=O)CC2=CC=CC=C2
| PubChem CID | 89584 |
|---|---|
| CAS | 22065-85-6 |
| Molecular Weight (g/mol) | 203.285 |
| MDL Number | MFCD02258902 |
| SMILES | C1CN(CCC1C=O)CC2=CC=CC=C2 |
| Synonym | 1-benzyl-4-piperidinecarboxaldehyde,n-benzylpiperidine-4-carboxaldehyde,1-benzyl-4-formylpiperidine,1-benzylpiperidine-4-carboxaldehyde,1-benzy-4-piperidine carboxyaldehyde,1-benzyl-4-piperidinecarbaldehyde,1-benzyl-piperidine-4-carbaldehyde,n-benzyl piperidine-4-carboxaldehyde,4-piperidinecarboxaldehyde, 1-phenylmethyl,n-benzyl-4-formylpiperidine |
| IUPAC Name | 1-benzylpiperidine-4-carbaldehyde |
| InChI Key | SGIBOXBBPQRZDM-UHFFFAOYSA-N |
| Molecular Formula | C13H17NO |
O-(Benzotriazol-1-yl)-N,N,N',N'-bis(pentamethylene)uronium Hexafluorophosphate 98.0+%, TCI America™
CAS: 206752-41-2 Molecular Formula: C17H24F6N5OP Molecular Weight (g/mol): 459.377 MDL Number: MFCD00191769 InChI Key: YNOBMGHLCWIWCL-UHFFFAOYSA-N Synonym: (Benzotriazol-1-yloxy)dipiperidinocarbenium Hexafluorophosphate, HBPipU PubChem CID: 10863473 IUPAC Name: 1-[piperidin-1-ium-1-ylidene(piperidin-1-yl)methoxy]benzotriazole;hexafluorophosphate SMILES: C1CCN(CC1)C(=[N+]2CCCCC2)ON3C4=CC=CC=C4N=N3.F[P-](F)(F)(F)(F)F
| PubChem CID | 10863473 |
|---|---|
| CAS | 206752-41-2 |
| Molecular Weight (g/mol) | 459.377 |
| MDL Number | MFCD00191769 |
| SMILES | C1CCN(CC1)C(=[N+]2CCCCC2)ON3C4=CC=CC=C4N=N3.F[P-](F)(F)(F)(F)F |
| Synonym | (Benzotriazol-1-yloxy)dipiperidinocarbenium Hexafluorophosphate, HBPipU |
| IUPAC Name | 1-[piperidin-1-ium-1-ylidene(piperidin-1-yl)methoxy]benzotriazole;hexafluorophosphate |
| InChI Key | YNOBMGHLCWIWCL-UHFFFAOYSA-N |
| Molecular Formula | C17H24F6N5OP |
1-(Ethoxycarbonyl)-4-piperidinecarboxylic Acid 98.0+%, TCI America™
CAS: 118133-15-6 Molecular Formula: C9H15NO4 Molecular Weight (g/mol): 201.222 MDL Number: MFCD07339354 InChI Key: BVEBMPFJSMEGJX-UHFFFAOYSA-N Synonym: 1-(Ethoxycarbonyl)isonipecotic Acid PubChem CID: 6618886 IUPAC Name: 1-ethoxycarbonylpiperidine-4-carboxylic acid SMILES: CCOC(=O)N1CCC(CC1)C(=O)O
| PubChem CID | 6618886 |
|---|---|
| CAS | 118133-15-6 |
| Molecular Weight (g/mol) | 201.222 |
| MDL Number | MFCD07339354 |
| SMILES | CCOC(=O)N1CCC(CC1)C(=O)O |
| Synonym | 1-(Ethoxycarbonyl)isonipecotic Acid |
| IUPAC Name | 1-ethoxycarbonylpiperidine-4-carboxylic acid |
| InChI Key | BVEBMPFJSMEGJX-UHFFFAOYSA-N |
| Molecular Formula | C9H15NO4 |
1-(tert-Butoxycarbonyl)piperidine 98.0+%, TCI America™
CAS: 75844-69-8 Molecular Formula: C10H19NO2 Molecular Weight (g/mol): 185.267 MDL Number: MFCD02093935 InChI Key: RQCNHUCCQJMSRG-UHFFFAOYSA-N Synonym: 1-boc-piperidine,n-boc-piperidine,1-tert-butoxycarbonyl piperidine,1-piperidinecarboxylic acid, 1,1-dimethylethyl ester,piperidine-1-carboxylic acid tert-butyl ester,tert-butyl piperidinecarboxylate,boc-piperidine,n-boc piperidine,pubchem7258,n-boc tetrahydropyridine PubChem CID: 7010304 IUPAC Name: tert-butyl piperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCCCC1
| PubChem CID | 7010304 |
|---|---|
| CAS | 75844-69-8 |
| Molecular Weight (g/mol) | 185.267 |
| MDL Number | MFCD02093935 |
| SMILES | CC(C)(C)OC(=O)N1CCCCC1 |
| Synonym | 1-boc-piperidine,n-boc-piperidine,1-tert-butoxycarbonyl piperidine,1-piperidinecarboxylic acid, 1,1-dimethylethyl ester,piperidine-1-carboxylic acid tert-butyl ester,tert-butyl piperidinecarboxylate,boc-piperidine,n-boc piperidine,pubchem7258,n-boc tetrahydropyridine |
| IUPAC Name | tert-butyl piperidine-1-carboxylate |
| InChI Key | RQCNHUCCQJMSRG-UHFFFAOYSA-N |
| Molecular Formula | C10H19NO2 |
4-[4-Chloro-3-(trifluoromethyl)phenyl]-4-hydroxypiperidine 98.0+%, TCI America™
CAS: 21928-50-7 Molecular Formula: C12H13ClF3NO Molecular Weight (g/mol): 279.687 MDL Number: MFCD00066999 InChI Key: RALRVIPTUXSBPO-UHFFFAOYSA-N Synonym: 4-4-chloro-3-trifluoromethyl phenyl-4-piperidinol,4-4-chloro-3-trifluoromethyl phenyl piperidin-4-ol,4-piperidinol, 4-4-chloro-3-trifluoromethyl phenyl,4-4-chloro-3-trifluoromethyl phenyl-4-hydroxypiperidine,piperidine alcohol,4-4-chloro-3-trifluoromethylphenyl-4-piperidinol,piperidinalkohol PubChem CID: 89107 IUPAC Name: 4-[4-chloro-3-(trifluoromethyl)phenyl]piperidin-4-ol SMILES: C1CNCCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O
| PubChem CID | 89107 |
|---|---|
| CAS | 21928-50-7 |
| Molecular Weight (g/mol) | 279.687 |
| MDL Number | MFCD00066999 |
| SMILES | C1CNCCC1(C2=CC(=C(C=C2)Cl)C(F)(F)F)O |
| Synonym | 4-4-chloro-3-trifluoromethyl phenyl-4-piperidinol,4-4-chloro-3-trifluoromethyl phenyl piperidin-4-ol,4-piperidinol, 4-4-chloro-3-trifluoromethyl phenyl,4-4-chloro-3-trifluoromethyl phenyl-4-hydroxypiperidine,piperidine alcohol,4-4-chloro-3-trifluoromethylphenyl-4-piperidinol,piperidinalkohol |
| IUPAC Name | 4-[4-chloro-3-(trifluoromethyl)phenyl]piperidin-4-ol |
| InChI Key | RALRVIPTUXSBPO-UHFFFAOYSA-N |
| Molecular Formula | C12H13ClF3NO |
N-(tert-Butoxycarbonyl)nortropinone 98.0+%, TCI America™
CAS: 185099-67-6 Molecular Formula: C12H19NO3 Molecular Weight (g/mol): 225.288 MDL Number: MFCD00673779 InChI Key: MENILFUADYEXNU-UHFFFAOYSA-N Synonym: tert-butyl 3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylate,n-boc-nortropinone,n-boc-4-nortropinone,n-tert-butoxycarbonyl nortropinone,8-boc-8-azabicyclo 3.2.1 octan-3-one,3-oxo-8-aza-bicyclo 3.2.1 octane-8-carboxylic acid tert-butyl ester,t-butyl 3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylate,3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylic acid tert-butyl ester,n-boc-nororopinone,8-tert-butoxycarbonyl-8-azabicyclo 3.2.1 octan-3-one; PubChem CID: 2794767 IUPAC Name: tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate SMILES: CC(C)(C)OC(=O)N1C2CCC1CC(=O)C2
| PubChem CID | 2794767 |
|---|---|
| CAS | 185099-67-6 |
| Molecular Weight (g/mol) | 225.288 |
| MDL Number | MFCD00673779 |
| SMILES | CC(C)(C)OC(=O)N1C2CCC1CC(=O)C2 |
| Synonym | tert-butyl 3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylate,n-boc-nortropinone,n-boc-4-nortropinone,n-tert-butoxycarbonyl nortropinone,8-boc-8-azabicyclo 3.2.1 octan-3-one,3-oxo-8-aza-bicyclo 3.2.1 octane-8-carboxylic acid tert-butyl ester,t-butyl 3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylate,3-oxo-8-azabicyclo 3.2.1 octane-8-carboxylic acid tert-butyl ester,n-boc-nororopinone,8-tert-butoxycarbonyl-8-azabicyclo 3.2.1 octan-3-one; |
| IUPAC Name | tert-butyl 3-oxo-8-azabicyclo[3.2.1]octane-8-carboxylate |
| InChI Key | MENILFUADYEXNU-UHFFFAOYSA-N |
| Molecular Formula | C12H19NO3 |
Methyl 4-Oxopiperidine-3-carboxylate Hydrochloride 98.0+%, TCI America™
CAS: 71486-53-8 Molecular Formula: C7H12ClNO3 Molecular Weight (g/mol): 193.627 MDL Number: MFCD00012769 InChI Key: NMAACQILAGCQPR-UHFFFAOYSA-N Synonym: methyl 4-oxopiperidine-3-carboxylate hydrochloride,methyl 4-oxo-3-piperidinecarboxylate hydrochloride,3-methoxycarbonyl-4-piperidone hydrochloride,methyl 4-oxo-3-piperidinecarboxylate hcl,3-piperidinecarboxylic acid, 4-oxo-, methyl ester, hydrochloride,3-methoxycarbonyl-4-oxopiperidinium chloride,methyl 4-oxopiperidine-3-carboxylate, chloride,4-piperidine carboxylic acid methyl ketone 3-hydrochloride,pubchem12958,methyl 4-oxopiperidine-3-carboxylate hcl PubChem CID: 2724028 IUPAC Name: methyl 4-oxopiperidine-3-carboxylate;hydrochloride SMILES: COC(=O)C1CNCCC1=O.Cl
| PubChem CID | 2724028 |
|---|---|
| CAS | 71486-53-8 |
| Molecular Weight (g/mol) | 193.627 |
| MDL Number | MFCD00012769 |
| SMILES | COC(=O)C1CNCCC1=O.Cl |
| Synonym | methyl 4-oxopiperidine-3-carboxylate hydrochloride,methyl 4-oxo-3-piperidinecarboxylate hydrochloride,3-methoxycarbonyl-4-piperidone hydrochloride,methyl 4-oxo-3-piperidinecarboxylate hcl,3-piperidinecarboxylic acid, 4-oxo-, methyl ester, hydrochloride,3-methoxycarbonyl-4-oxopiperidinium chloride,methyl 4-oxopiperidine-3-carboxylate, chloride,4-piperidine carboxylic acid methyl ketone 3-hydrochloride,pubchem12958,methyl 4-oxopiperidine-3-carboxylate hcl |
| IUPAC Name | methyl 4-oxopiperidine-3-carboxylate;hydrochloride |
| InChI Key | NMAACQILAGCQPR-UHFFFAOYSA-N |
| Molecular Formula | C7H12ClNO3 |
4-Amino-1-[2-(4-methoxyphenyl)ethyl]piperidine 98.0+%, TCI America™
CAS: 85098-70-0 Molecular Formula: C14H22N2O Molecular Weight (g/mol): 234.34 MDL Number: MFCD01631147 InChI Key: HTGMIBQQTLUEKV-UHFFFAOYSA-N Synonym: 4-Amino-1-(4-methoxyphenethyl)piperidine, 1-(4-Methoxyphenethyl)-4-aminopiperidine, 1-[2-(4-Methoxyphenyl)ethyl]-4-aminopiperidine PubChem CID: 3020332 IUPAC Name: 1-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine SMILES: COC1=CC=C(CCN2CCC(N)CC2)C=C1
| PubChem CID | 3020332 |
|---|---|
| CAS | 85098-70-0 |
| Molecular Weight (g/mol) | 234.34 |
| MDL Number | MFCD01631147 |
| SMILES | COC1=CC=C(CCN2CCC(N)CC2)C=C1 |
| Synonym | 4-Amino-1-(4-methoxyphenethyl)piperidine, 1-(4-Methoxyphenethyl)-4-aminopiperidine, 1-[2-(4-Methoxyphenyl)ethyl]-4-aminopiperidine |
| IUPAC Name | 1-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine |
| InChI Key | HTGMIBQQTLUEKV-UHFFFAOYSA-N |
| Molecular Formula | C14H22N2O |
1-Methyl-4-(methylamino)piperidine 97.0+%, TCI America™
CAS: 73579-08-5 Molecular Formula: C7H16N2 Molecular Weight (g/mol): 128.219 MDL Number: MFCD00006498 InChI Key: XRYGCVVVDCEPRL-UHFFFAOYSA-N PubChem CID: 566323 IUPAC Name: N,1-dimethylpiperidin-4-amine SMILES: CNC1CCN(CC1)C
| PubChem CID | 566323 |
|---|---|
| CAS | 73579-08-5 |
| Molecular Weight (g/mol) | 128.219 |
| MDL Number | MFCD00006498 |
| SMILES | CNC1CCN(CC1)C |
| IUPAC Name | N,1-dimethylpiperidin-4-amine |
| InChI Key | XRYGCVVVDCEPRL-UHFFFAOYSA-N |
| Molecular Formula | C7H16N2 |
3-Ethoxycarbonyl-2-piperidone 98.0+%, TCI America™
CAS: 3731-16-6 Molecular Formula: C8H13NO3 Molecular Weight (g/mol): 171.196 MDL Number: MFCD00006038 InChI Key: DUMNOWYWTAYLJN-UHFFFAOYSA-N Synonym: Ethyl 2-Piperidone-3-carboxylate, Ethyl 2-Oxo-3-piperidinecarboxylate, 2-Oxo-3-piperidinecarboxylic Acid Ethyl Ester PubChem CID: 97773 IUPAC Name: ethyl 2-oxopiperidine-3-carboxylate SMILES: CCOC(=O)C1CCCNC1=O
| PubChem CID | 97773 |
|---|---|
| CAS | 3731-16-6 |
| Molecular Weight (g/mol) | 171.196 |
| MDL Number | MFCD00006038 |
| SMILES | CCOC(=O)C1CCCNC1=O |
| Synonym | Ethyl 2-Piperidone-3-carboxylate, Ethyl 2-Oxo-3-piperidinecarboxylate, 2-Oxo-3-piperidinecarboxylic Acid Ethyl Ester |
| IUPAC Name | ethyl 2-oxopiperidine-3-carboxylate |
| InChI Key | DUMNOWYWTAYLJN-UHFFFAOYSA-N |
| Molecular Formula | C8H13NO3 |
4-(3-Hydroxyphenyl)piperidine 98.0+%, TCI America™
CAS: 110878-71-2 Molecular Formula: C11H15NO Molecular Weight (g/mol): 177.247 MDL Number: MFCD02093474 InChI Key: FINLIMGQGJZNRN-UHFFFAOYSA-N Synonym: 3-(4-Piperidyl)phenol PubChem CID: 10583453 IUPAC Name: 3-piperidin-4-ylphenol SMILES: C1CNCCC1C2=CC(=CC=C2)O
| PubChem CID | 10583453 |
|---|---|
| CAS | 110878-71-2 |
| Molecular Weight (g/mol) | 177.247 |
| MDL Number | MFCD02093474 |
| SMILES | C1CNCCC1C2=CC(=CC=C2)O |
| Synonym | 3-(4-Piperidyl)phenol |
| IUPAC Name | 3-piperidin-4-ylphenol |
| InChI Key | FINLIMGQGJZNRN-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO |
Ethyl 1-(tert-Butoxycarbonyl)-3-piperidinecarboxylate 98.0+%, TCI America™
CAS: 130250-54-3 Molecular Formula: C13H23NO4 Molecular Weight (g/mol): 257.33 MDL Number: MFCD04116274 InChI Key: YCXCRFGBFZTUSU-UHFFFAOYSA-N Synonym: ethyl 1-boc-3-piperidinecarboxylate,1-tert-butyl 3-ethyl piperidine-1,3-dicarboxylate,ethyl n-boc-piperidine-3-carboxylate,ethyl n-boc-3-piperidinecarboxylate,ethyl1-boc-3-piperidinecarboxylate,1-boc-piperidine-3-carboxylic acid ethyl ester,ethyl-n-boc-piperidine-3-carboxylate,1-tert-butyl 3-ethyl tetrahydro-1,3 2h-pyridinedicarboxylate,1,3-piperidinedicarboxylic acid, 1-1,1-dimethylethyl 3-ethyl ester,piperidine-1,3-dicarboxylic acid 1-tert-butyl 3-ethyl ester PubChem CID: 357727 IUPAC Name: 1-O-tert-butyl 3-O-ethyl piperidine-1,3-dicarboxylate SMILES: CCOC(=O)C1CCCN(C1)C(=O)OC(C)(C)C
| PubChem CID | 357727 |
|---|---|
| CAS | 130250-54-3 |
| Molecular Weight (g/mol) | 257.33 |
| MDL Number | MFCD04116274 |
| SMILES | CCOC(=O)C1CCCN(C1)C(=O)OC(C)(C)C |
| Synonym | ethyl 1-boc-3-piperidinecarboxylate,1-tert-butyl 3-ethyl piperidine-1,3-dicarboxylate,ethyl n-boc-piperidine-3-carboxylate,ethyl n-boc-3-piperidinecarboxylate,ethyl1-boc-3-piperidinecarboxylate,1-boc-piperidine-3-carboxylic acid ethyl ester,ethyl-n-boc-piperidine-3-carboxylate,1-tert-butyl 3-ethyl tetrahydro-1,3 2h-pyridinedicarboxylate,1,3-piperidinedicarboxylic acid, 1-1,1-dimethylethyl 3-ethyl ester,piperidine-1,3-dicarboxylic acid 1-tert-butyl 3-ethyl ester |
| IUPAC Name | 1-O-tert-butyl 3-O-ethyl piperidine-1,3-dicarboxylate |
| InChI Key | YCXCRFGBFZTUSU-UHFFFAOYSA-N |
| Molecular Formula | C13H23NO4 |
Ethyl 1-Benzyl-3-oxo-4-piperidinecarboxylate Hydrochloride 98.0+%, TCI America™
CAS: 52763-21-0 Molecular Formula: C15H20ClNO3 Molecular Weight (g/mol): 297.78 MDL Number: MFCD00012792 InChI Key: UQOMEAWPKSISII-UHFFFAOYNA-N Synonym: ethyl 1-benzyl-3-oxopiperidine-4-carboxylate hydrochloride,ethyl n-benzyl-3-oxo-4-piperidine-carboxylate hydrochloride,ethyl 1-benzyl-3-oxo-4-piperidinecarboxylate hydrochloride,1-benzyl-4-ethoxycarbonyl-3-piperidone hydrochloride,ethyl 1-benzyl-3-oxo-piperidine-4-carboxylate hcl,ethyl 1-benzyl-3-oxo-piperidine-4-carboxylate hydrochloride,1-benzyl-3-oxopiperidine-4-carboxylic acid ethyl ester hydrochloride,ethyl n-benzyl-3-oxopiperidine-4-carboxylate hydrochloride,zlchem 420,pubchem19671 PubChem CID: 2723880 IUPAC Name: hydrogen ethyl 1-benzyl-3-oxopiperidine-4-carboxylate chloride SMILES: [H+].[Cl-].CCOC(=O)C1CCN(CC2=CC=CC=C2)CC1=O
| PubChem CID | 2723880 |
|---|---|
| CAS | 52763-21-0 |
| Molecular Weight (g/mol) | 297.78 |
| MDL Number | MFCD00012792 |
| SMILES | [H+].[Cl-].CCOC(=O)C1CCN(CC2=CC=CC=C2)CC1=O |
| Synonym | ethyl 1-benzyl-3-oxopiperidine-4-carboxylate hydrochloride,ethyl n-benzyl-3-oxo-4-piperidine-carboxylate hydrochloride,ethyl 1-benzyl-3-oxo-4-piperidinecarboxylate hydrochloride,1-benzyl-4-ethoxycarbonyl-3-piperidone hydrochloride,ethyl 1-benzyl-3-oxo-piperidine-4-carboxylate hcl,ethyl 1-benzyl-3-oxo-piperidine-4-carboxylate hydrochloride,1-benzyl-3-oxopiperidine-4-carboxylic acid ethyl ester hydrochloride,ethyl n-benzyl-3-oxopiperidine-4-carboxylate hydrochloride,zlchem 420,pubchem19671 |
| IUPAC Name | hydrogen ethyl 1-benzyl-3-oxopiperidine-4-carboxylate chloride |
| InChI Key | UQOMEAWPKSISII-UHFFFAOYNA-N |
| Molecular Formula | C15H20ClNO3 |