1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide

C19H26N2O3 — CID 111333032

IUPAC1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide
SMILESO=C(NCC1(O)CCCC1)C1CCCN(C(=O)c2ccccc2)C1
InChIInChI=1S/C19H26N2O3/c22-17(20-14-19(24)10-4-5-11-19)16-9-6-12-21(13-16)18(23)15-7-2-1-3-8-15/h1-3,7-8,16,24H,4-6,9-14H2,(H,20,22)
InChIKeyJBXDISUROOCHML-UHFFFAOYSA-N
MW330.43 g/mol
LogP1.96
Rot. Bonds4

About 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide

1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide (PubChem CID 111333032) has the molecular formula C19H26N2O3 and a molecular weight of 330.43 g/mol. Its IUPAC name is 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide
PubChem CID111333032
Molecular FormulaC19H26N2O3
Molecular Weight330.43 g/mol
Exact Mass330.19
IUPAC Name1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide
SMILESO=C(NCC1(O)CCCC1)C1CCCN(C(=O)c2ccccc2)C1
InChIInChI=1S/C19H26N2O3/c22-17(20-14-19(24)10-4-5-11-19)16-9-6-12-21(13-16)18(23)15-7-2-1-3-8-15/h1-3,7-8,16,24H,4-6,9-14H2,(H,20,22)
InChIKeyJBXDISUROOCHML-UHFFFAOYSA-N
XLogP1.96
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.43
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzoyl-N-[2-(cycloheptylamino)ethyl]piperidine-3-carboxamide;hydrochloride
CID 119621206
N-[(3S)-1-benzoylpiperidin-3-yl]-2-(1-hydroxycyclohexyl)acetamide
CID 95906190
1-benzoyl-N-octylpiperidine-3-carboxamide
CID 70028584
N-(2-amino-2-phenylethyl)-1-benzoylpiperidine-3-carboxamide
CID 119529448
1-(furan-3-carbonyl)-N-[(1-hydroxycyclohexyl)methyl]piperidine-4-carboxamide
CID 111445987
1-benzoyl-N-(1-hydroxy-2-methylpropan-2-yl)piperidine-3-carboxamide
CID 110000883
1-benzoylpiperidine-3-carbonyl chloride
CID 15718173
N-[2-(aminomethyl)cyclohexyl]-1-benzoylpiperidine-3-carboxamide
CID 119612151
1-benzoyl-N-(4-hydroxycyclohexyl)piperidine-3-carboxamide
CID 69258968
4-[(1-benzoylpiperidine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 119229696
(2S)-2-[(1-benzoylpiperidine-3-carbonyl)amino]propanoic acid
CID 119238223
N-[(1-hydroxycyclohexyl)methyl]cycloheptanecarboxamide
CID 65114198

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide?
The IUPAC name of 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide (CID 111333032) is 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide?
The canonical SMILES for 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide is O=C(NCC1(O)CCCC1)C1CCCN(C(=O)c2ccccc2)C1.
What is the InChIKey of 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide?
The InChIKey is JBXDISUROOCHML-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O3/c22-17(20-14-19(24)10-4-5-11-19)16-9-6-12-21(13-16)18(23)15-7-2-1-3-8-15/h1-3,7-8,16,24H,4-6,9-14H2,(H,20,22).
What are the key properties of 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide?
1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide has a molecular weight of 330.43 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-[(1-hydroxycyclopentyl)methyl]piperidine-3-carboxamide is sourced from PubChem (CID 111333032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).