Organoheterocyclic compounds
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Cyclopentene oxide, 97%
CAS: 285-67-6 Molecular Formula: C5H8O Molecular Weight (g/mol): 84.12 MDL Number: MFCD00005161 InChI Key: GJEZBVHHZQAEDB-UHFFFAOYNA-N Synonym: cyclopentene oxide,6-oxabicyclo 3.1.0 hexane,1,2-epoxycyclopentane,cyclopentane oxide,cyclopentene epoxide,epoxycyclopentane,cis-1,2-epoxycyclopentane,cyclopentane, 1,2-epoxy,6-oxa-bicyclo 3.1.0 hexane PubChem CID: 9244 IUPAC Name: 6-oxabicyclo[3.1.0]hexane SMILES: C1CC2OC2C1
| PubChem CID | 9244 |
|---|---|
| CAS | 285-67-6 |
| Molecular Weight (g/mol) | 84.12 |
| MDL Number | MFCD00005161 |
| SMILES | C1CC2OC2C1 |
| Synonym | cyclopentene oxide,6-oxabicyclo 3.1.0 hexane,1,2-epoxycyclopentane,cyclopentane oxide,cyclopentene epoxide,epoxycyclopentane,cis-1,2-epoxycyclopentane,cyclopentane, 1,2-epoxy,6-oxa-bicyclo 3.1.0 hexane |
| IUPAC Name | 6-oxabicyclo[3.1.0]hexane |
| InChI Key | GJEZBVHHZQAEDB-UHFFFAOYNA-N |
| Molecular Formula | C5H8O |
Tetrahydropyran-4-sulfonyl chloride, 97%
CAS: 338453-21-7 Molecular Formula: C5H9ClO3S Molecular Weight (g/mol): 184.64 InChI Key: QQSBPTQNEOJFBO-UHFFFAOYSA-N Synonym: tetrahydro-2h-pyran-4-sulfonyl chloride,tetrahydropyran-4-sulfonyl chloride,tetrahydro-pyran-4-sulfonyl chloride,2h-pyran-4-sulfonylchloride, tetrahydro,tetrahydropyran-4-sulfonylchloride,tetrahydropyran-4-sulphonyl chloride,2h-pyran-4-sulfonylchloride,tetrahydro,n-5-bromo-2-methoxybenzyl cyclohexanamine hydrobromide PubChem CID: 22637030 IUPAC Name: oxane-4-sulfonyl chloride SMILES: C1COCCC1S(=O)(=O)Cl
| PubChem CID | 22637030 |
|---|---|
| CAS | 338453-21-7 |
| Molecular Weight (g/mol) | 184.64 |
| SMILES | C1COCCC1S(=O)(=O)Cl |
| Synonym | tetrahydro-2h-pyran-4-sulfonyl chloride,tetrahydropyran-4-sulfonyl chloride,tetrahydro-pyran-4-sulfonyl chloride,2h-pyran-4-sulfonylchloride, tetrahydro,tetrahydropyran-4-sulfonylchloride,tetrahydropyran-4-sulphonyl chloride,2h-pyran-4-sulfonylchloride,tetrahydro,n-5-bromo-2-methoxybenzyl cyclohexanamine hydrobromide |
| IUPAC Name | oxane-4-sulfonyl chloride |
| InChI Key | QQSBPTQNEOJFBO-UHFFFAOYSA-N |
| Molecular Formula | C5H9ClO3S |
1-Benzyl-4-piperidone, 98+%
CAS: 3612-20-2 Molecular Formula: C12H15NO Molecular Weight (g/mol): 189.258 MDL Number: MFCD00006192 InChI Key: SJZKULRDWHPHGG-UHFFFAOYSA-N Synonym: 1-benzyl-4-piperidone,n-benzyl-4-piperidone,4-piperidinone, 1-phenylmethyl,1-benzyl-4-piperidinone,1-benzylpiperidone,1-benzyl-4-oxopiperidine,1-benzyl-piperidin-4-one,n-benzyl-4-piperidine,n-benzyl-4-piperidinone,n-benzylpiperidin-4-one PubChem CID: 19220 IUPAC Name: 1-benzylpiperidin-4-one SMILES: C1CN(CCC1=O)CC2=CC=CC=C2
| PubChem CID | 19220 |
|---|---|
| CAS | 3612-20-2 |
| Molecular Weight (g/mol) | 189.258 |
| MDL Number | MFCD00006192 |
| SMILES | C1CN(CCC1=O)CC2=CC=CC=C2 |
| Synonym | 1-benzyl-4-piperidone,n-benzyl-4-piperidone,4-piperidinone, 1-phenylmethyl,1-benzyl-4-piperidinone,1-benzylpiperidone,1-benzyl-4-oxopiperidine,1-benzyl-piperidin-4-one,n-benzyl-4-piperidine,n-benzyl-4-piperidinone,n-benzylpiperidin-4-one |
| IUPAC Name | 1-benzylpiperidin-4-one |
| InChI Key | SJZKULRDWHPHGG-UHFFFAOYSA-N |
| Molecular Formula | C12H15NO |
1-Boc-D-nipecotic acid, 97%
CAS: 163438-09-3 Molecular Formula: C11H18NO4 Molecular Weight (g/mol): 228.27 MDL Number: MFCD02179173 InChI Key: NXILIHONWRXHFA-MRVPVSSYSA-M Synonym: r-boc-nipecotic acid,r-1-tert-butoxycarbonyl piperidine-3-carboxylic acid,r-n-boc-piperidine-3-carboxylic acid,boc-d-nip-oh,r-1-boc-piperidine-3-carboxylic acid,r-1-boc-nipecotic acid,d-1-boc-nipecotic acid,n-boc-r-nipecotic acid,r-boc-nip,r-boc-nip-oh PubChem CID: 643516 SMILES: CC(C)(C)OC(=O)N1CCC[C@H](C1)C([O-])=O
| PubChem CID | 643516 |
|---|---|
| CAS | 163438-09-3 |
| Molecular Weight (g/mol) | 228.27 |
| MDL Number | MFCD02179173 |
| SMILES | CC(C)(C)OC(=O)N1CCC[C@H](C1)C([O-])=O |
| Synonym | r-boc-nipecotic acid,r-1-tert-butoxycarbonyl piperidine-3-carboxylic acid,r-n-boc-piperidine-3-carboxylic acid,boc-d-nip-oh,r-1-boc-piperidine-3-carboxylic acid,r-1-boc-nipecotic acid,d-1-boc-nipecotic acid,n-boc-r-nipecotic acid,r-boc-nip,r-boc-nip-oh |
| InChI Key | NXILIHONWRXHFA-MRVPVSSYSA-M |
| Molecular Formula | C11H18NO4 |
Ethyl 1-Boc-3-oxopiperidine-4-carboxylate, 97%, Thermo Scientific Chemicals
CAS: 71233-25-5 Molecular Formula: C13H21NO5 Molecular Weight (g/mol): 271.313 MDL Number: MFCD09878815 InChI Key: WCTXJAXKORIYNA-UHFFFAOYSA-N Synonym: 1-tert-butyl 4-ethyl 3-oxopiperidine-1,4-dicarboxylate,ethyl 1-n-boc-3-oxopiperidine-4-carboxylate,ethyl n-boc-3-oxopiperidine-4-carboxylate,3-oxo-piperidine-1,4-dicarboxylic acid 1-tert-butyl ester 4-ethyl ester,ethyl 1-n-boc-3-oxo-piperidine-4-carboxylate,ethyl 1-boc-3-oxopiperidine-4-carboxylate,ethyl n-tert-butoxycarbonyl-3-oxo-piperidine-4-carboxylate,1-tert-butyl 4-ethyl 3-oxo-1,4-piperidinedicarboxylate,1,4-piperidinedicarboxylic acid, 3-oxo-, 1-1,1-dimethylethyl 4-ethyl ester,ksc915i7p PubChem CID: 15852989 IUPAC Name: 1-O-tert-butyl 4-O-ethyl 3-oxopiperidine-1,4-dicarboxylate SMILES: CCOC(=O)C1CCN(CC1=O)C(=O)OC(C)(C)C
| PubChem CID | 15852989 |
|---|---|
| CAS | 71233-25-5 |
| Molecular Weight (g/mol) | 271.313 |
| MDL Number | MFCD09878815 |
| SMILES | CCOC(=O)C1CCN(CC1=O)C(=O)OC(C)(C)C |
| Synonym | 1-tert-butyl 4-ethyl 3-oxopiperidine-1,4-dicarboxylate,ethyl 1-n-boc-3-oxopiperidine-4-carboxylate,ethyl n-boc-3-oxopiperidine-4-carboxylate,3-oxo-piperidine-1,4-dicarboxylic acid 1-tert-butyl ester 4-ethyl ester,ethyl 1-n-boc-3-oxo-piperidine-4-carboxylate,ethyl 1-boc-3-oxopiperidine-4-carboxylate,ethyl n-tert-butoxycarbonyl-3-oxo-piperidine-4-carboxylate,1-tert-butyl 4-ethyl 3-oxo-1,4-piperidinedicarboxylate,1,4-piperidinedicarboxylic acid, 3-oxo-, 1-1,1-dimethylethyl 4-ethyl ester,ksc915i7p |
| IUPAC Name | 1-O-tert-butyl 4-O-ethyl 3-oxopiperidine-1,4-dicarboxylate |
| InChI Key | WCTXJAXKORIYNA-UHFFFAOYSA-N |
| Molecular Formula | C13H21NO5 |
3-Piperidinobenzaldehyde, 95%, Thermo Scientific™
CAS: 669050-72-0 Molecular Formula: C12H15NO Molecular Weight (g/mol): 189.258 InChI Key: FXXQUTSXXILOMY-UHFFFAOYSA-N Synonym: 3-piperidinobenzaldehyde,3-piperidin-1-yl benzaldehyde,benzaldehyde, 3-1-piperidinyl,3-piperidylbenzaldehyde,3-1-piperidinyl benzaldehyde PubChem CID: 7164587 IUPAC Name: 3-piperidin-1-ylbenzaldehyde SMILES: C1CCN(CC1)C2=CC=CC(=C2)C=O
| PubChem CID | 7164587 |
|---|---|
| CAS | 669050-72-0 |
| Molecular Weight (g/mol) | 189.258 |
| SMILES | C1CCN(CC1)C2=CC=CC(=C2)C=O |
| Synonym | 3-piperidinobenzaldehyde,3-piperidin-1-yl benzaldehyde,benzaldehyde, 3-1-piperidinyl,3-piperidylbenzaldehyde,3-1-piperidinyl benzaldehyde |
| IUPAC Name | 3-piperidin-1-ylbenzaldehyde |
| InChI Key | FXXQUTSXXILOMY-UHFFFAOYSA-N |
| Molecular Formula | C12H15NO |
1-Thieno[3,2-d]pyrimidin-4-ylpiperidine-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 910037-25-1 Molecular Formula: C12H13N3O2S Molecular Weight (g/mol): 263.32 MDL Number: MFCD09065023 InChI Key: VWNHOIKUCNKRDY-UHFFFAOYSA-N Synonym: 1-thieno 3,2-d pyrimidin-4-ylpiperidine-4-carboxylic acid,1-thieno 3,2-d pyrimidin-4-yl piperidine-4-carboxylic acid,4-piperidinecarboxylicacid,1-thieno 3,2-d pyrimidin-4-yl,1-thiopheno 2,3-e pyrimidin-4-ylpiperidine-4-carboxylic acid,4-piperidinecarboxylicacid, 1-thieno 3,2-d pyrimidin-4-yl PubChem CID: 24229705 IUPAC Name: 1-thieno[3,2-d]pyrimidin-4-ylpiperidine-4-carboxylic acid SMILES: OC(=O)C1CCN(CC1)C1=C2SC=CC2=NC=N1
| PubChem CID | 24229705 |
|---|---|
| CAS | 910037-25-1 |
| Molecular Weight (g/mol) | 263.32 |
| MDL Number | MFCD09065023 |
| SMILES | OC(=O)C1CCN(CC1)C1=C2SC=CC2=NC=N1 |
| Synonym | 1-thieno 3,2-d pyrimidin-4-ylpiperidine-4-carboxylic acid,1-thieno 3,2-d pyrimidin-4-yl piperidine-4-carboxylic acid,4-piperidinecarboxylicacid,1-thieno 3,2-d pyrimidin-4-yl,1-thiopheno 2,3-e pyrimidin-4-ylpiperidine-4-carboxylic acid,4-piperidinecarboxylicacid, 1-thieno 3,2-d pyrimidin-4-yl |
| IUPAC Name | 1-thieno[3,2-d]pyrimidin-4-ylpiperidine-4-carboxylic acid |
| InChI Key | VWNHOIKUCNKRDY-UHFFFAOYSA-N |
| Molecular Formula | C12H13N3O2S |
ethyle1-(3-aminobenzyl)piperidine-4-carboxylate, 97%, Thermo Scientific™
CAS: 306937-22-4 Molecular Formula: C15H22N2O2 Molecular Weight (g/mol): 262.353 MDL Number: MFCD02180894 InChI Key: WXYBQSXOZUFNJY-UHFFFAOYSA-N PubChem CID: 2800723 IUPAC Name: ethyl 1-[(3-aminophenyl)methyl]piperidine-4-carboxylate SMILES: CCOC(=O)C1CCN(CC1)CC2=CC(=CC=C2)N
| PubChem CID | 2800723 |
|---|---|
| CAS | 306937-22-4 |
| Molecular Weight (g/mol) | 262.353 |
| MDL Number | MFCD02180894 |
| SMILES | CCOC(=O)C1CCN(CC1)CC2=CC(=CC=C2)N |
| IUPAC Name | ethyl 1-[(3-aminophenyl)methyl]piperidine-4-carboxylate |
| InChI Key | WXYBQSXOZUFNJY-UHFFFAOYSA-N |
| Molecular Formula | C15H22N2O2 |
1,4'-Bipiperidine, 99%
CAS: 4897-50-1 Molecular Formula: C10H20N2 Molecular Weight (g/mol): 168.284 MDL Number: MFCD00006475 InChI Key: QDVBKXJMLILLLB-UHFFFAOYSA-N Synonym: 4-piperidinopiperidine,1,4'-bipiperidine,4-piperidino-piperidine,1,4'-bipiperidyl,4-1-piperidinyl piperidine,1,4' bipiperidinyl,4-piperidin-1-yl piperidine,1,4-bipiperidine,1-piperidin-4-yl piperidine,4-piperidin-1-ylpiperidine PubChem CID: 78607 ChEBI: CHEBI:40117 IUPAC Name: 1-piperidin-4-ylpiperidine SMILES: C1CCN(CC1)C2CCNCC2
| PubChem CID | 78607 |
|---|---|
| CAS | 4897-50-1 |
| Molecular Weight (g/mol) | 168.284 |
| ChEBI | CHEBI:40117 |
| MDL Number | MFCD00006475 |
| SMILES | C1CCN(CC1)C2CCNCC2 |
| Synonym | 4-piperidinopiperidine,1,4'-bipiperidine,4-piperidino-piperidine,1,4'-bipiperidyl,4-1-piperidinyl piperidine,1,4' bipiperidinyl,4-piperidin-1-yl piperidine,1,4-bipiperidine,1-piperidin-4-yl piperidine,4-piperidin-1-ylpiperidine |
| IUPAC Name | 1-piperidin-4-ylpiperidine |
| InChI Key | QDVBKXJMLILLLB-UHFFFAOYSA-N |
| Molecular Formula | C10H20N2 |
tert-Butyl 4-(4-formyl-1,3-thiazol-2-yl)piperidine-1-carboxylate, ≥97%, Thermo Scientific™
CAS: 869901-02-0 Molecular Formula: C14H20N2O3S Molecular Weight (g/mol): 296.385 MDL Number: MFCD06658981 InChI Key: XLGKMJFDRZHAEV-UHFFFAOYSA-N PubChem CID: 7172298 IUPAC Name: tert-butyl 4-(4-formyl-1,3-thiazol-2-yl)piperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C=O
| PubChem CID | 7172298 |
|---|---|
| CAS | 869901-02-0 |
| Molecular Weight (g/mol) | 296.385 |
| MDL Number | MFCD06658981 |
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C=O |
| IUPAC Name | tert-butyl 4-(4-formyl-1,3-thiazol-2-yl)piperidine-1-carboxylate |
| InChI Key | XLGKMJFDRZHAEV-UHFFFAOYSA-N |
| Molecular Formula | C14H20N2O3S |
(+/-)-1-Boc-3-(hydroxymethyl)piperidine, 97%
CAS: 116574-71-1 Molecular Formula: C11H21NO3 Molecular Weight (g/mol): 215.293 MDL Number: MFCD03094733 InChI Key: OJCLHERKFHHUTB-UHFFFAOYSA-N Synonym: n-boc-piperidine-3-methanol,tert-butyl 3-hydroxymethyl piperidine-1-carboxylate,1-boc-3-piperidinemethanol,n-boc-3-piperidinemethanol,3-hydroxymethyl-1-n-boc-piperidine,n-boc-3-hydroxymethylpiperidine,1-boc-3-hydroxymethylpiperidine,1-boc-3-hydroxymethyl piperidine,tert-butyl 3-hydroxymethyl tetrahydro-1 2h-pyridinecarboxylate,+/--n-boc-3-piperidine methanol PubChem CID: 2763851 IUPAC Name: tert-butyl 3-(hydroxymethyl)piperidine-1-carboxylate SMILES: CC(C)(C)OC(=O)N1CCCC(C1)CO
| PubChem CID | 2763851 |
|---|---|
| CAS | 116574-71-1 |
| Molecular Weight (g/mol) | 215.293 |
| MDL Number | MFCD03094733 |
| SMILES | CC(C)(C)OC(=O)N1CCCC(C1)CO |
| Synonym | n-boc-piperidine-3-methanol,tert-butyl 3-hydroxymethyl piperidine-1-carboxylate,1-boc-3-piperidinemethanol,n-boc-3-piperidinemethanol,3-hydroxymethyl-1-n-boc-piperidine,n-boc-3-hydroxymethylpiperidine,1-boc-3-hydroxymethylpiperidine,1-boc-3-hydroxymethyl piperidine,tert-butyl 3-hydroxymethyl tetrahydro-1 2h-pyridinecarboxylate,+/--n-boc-3-piperidine methanol |
| IUPAC Name | tert-butyl 3-(hydroxymethyl)piperidine-1-carboxylate |
| InChI Key | OJCLHERKFHHUTB-UHFFFAOYSA-N |
| Molecular Formula | C11H21NO3 |
4-(piperidinomethyl)benzoic acid, 97%, Thermo Scientific™
CAS: 159691-33-5 Molecular Formula: C13H17NO2 Molecular Weight (g/mol): 219.284 InChI Key: RNCCMTVMMFUIKR-UHFFFAOYSA-N Synonym: 4-piperidin-1-ylmethyl benzoic acid,4-piperidin-1-ylmethyl-benzoic acid,benzoic acid,4-1-piperidinylmethyl,4-piperidylmethyl benzoic acid,4-piperidinomethyl benzoic acid,4-piperidin-1-yl methyl benzoic acid PubChem CID: 1092975 IUPAC Name: 4-(piperidin-1-ylmethyl)benzoic acid SMILES: C1CCN(CC1)CC2=CC=C(C=C2)C(=O)O
| PubChem CID | 1092975 |
|---|---|
| CAS | 159691-33-5 |
| Molecular Weight (g/mol) | 219.284 |
| SMILES | C1CCN(CC1)CC2=CC=C(C=C2)C(=O)O |
| Synonym | 4-piperidin-1-ylmethyl benzoic acid,4-piperidin-1-ylmethyl-benzoic acid,benzoic acid,4-1-piperidinylmethyl,4-piperidylmethyl benzoic acid,4-piperidinomethyl benzoic acid,4-piperidin-1-yl methyl benzoic acid |
| IUPAC Name | 4-(piperidin-1-ylmethyl)benzoic acid |
| InChI Key | RNCCMTVMMFUIKR-UHFFFAOYSA-N |
| Molecular Formula | C13H17NO2 |
Nortropinone hydrochloride, 97%
CAS: 25602-68-0 Molecular Formula: C7H12ClNO Molecular Weight (g/mol): 161.629 MDL Number: MFCD03613582 InChI Key: MZQWQFWRSDNBPV-UHFFFAOYSA-N Synonym: nortropinone hydrochloride,8-azabicyclo 3.2.1 octan-3-one hydrochloride,nortropinone hcl,8-azabicyclo 3.2.1 octan-3-one hcl,8-azabicyclo 3.2.1 octan-3-one, hydrochloride,3-nortropanone hydrochloride,8-aza-3-oxobicyclo 3.2.1 octane hydrochloride,nortropinonehydrochloride,c7h11no.clh,8-azabicyclo 3,2,1 octan-3-one hydrochloride PubChem CID: 13091218 IUPAC Name: 8-azabicyclo[3.2.1]octan-3-one;hydrochloride SMILES: C1CC2CC(=O)CC1N2.Cl
| PubChem CID | 13091218 |
|---|---|
| CAS | 25602-68-0 |
| Molecular Weight (g/mol) | 161.629 |
| MDL Number | MFCD03613582 |
| SMILES | C1CC2CC(=O)CC1N2.Cl |
| Synonym | nortropinone hydrochloride,8-azabicyclo 3.2.1 octan-3-one hydrochloride,nortropinone hcl,8-azabicyclo 3.2.1 octan-3-one hcl,8-azabicyclo 3.2.1 octan-3-one, hydrochloride,3-nortropanone hydrochloride,8-aza-3-oxobicyclo 3.2.1 octane hydrochloride,nortropinonehydrochloride,c7h11no.clh,8-azabicyclo 3,2,1 octan-3-one hydrochloride |
| IUPAC Name | 8-azabicyclo[3.2.1]octan-3-one;hydrochloride |
| InChI Key | MZQWQFWRSDNBPV-UHFFFAOYSA-N |
| Molecular Formula | C7H12ClNO |
4-(piperidin-1-ylmethyl)benzaldehyde, 95%, Thermo Scientific™
CAS: 471929-86-9 Molecular Formula: C13H17NO Molecular Weight (g/mol): 203.285 InChI Key: WWBOSCKXPMBVLG-UHFFFAOYSA-N PubChem CID: 7164649 IUPAC Name: 4-(piperidin-1-ylmethyl)benzaldehyde SMILES: C1CCN(CC1)CC2=CC=C(C=C2)C=O
| PubChem CID | 7164649 |
|---|---|
| CAS | 471929-86-9 |
| Molecular Weight (g/mol) | 203.285 |
| SMILES | C1CCN(CC1)CC2=CC=C(C=C2)C=O |
| IUPAC Name | 4-(piperidin-1-ylmethyl)benzaldehyde |
| InChI Key | WWBOSCKXPMBVLG-UHFFFAOYSA-N |
| Molecular Formula | C13H17NO |