1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide

C18H23ClN2O2 — CID 1072799

IUPAC1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide
SMILESO=C(NC1CCCC1)C1CCN(C(=O)c2ccccc2Cl)CC1
InChIInChI=1S/C18H23ClN2O2/c19-16-8-4-3-7-15(16)18(23)21-11-9-13(10-12-21)17(22)20-14-5-1-2-6-14/h3-4,7-8,13-14H,1-2,5-6,9-12H2,(H,20,22)
InChIKeyZESQELMUWGRXLO-UHFFFAOYSA-N
MW334.85 g/mol
LogP3.25
Rot. Bonds3

About 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide

1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide (PubChem CID 1072799) has the molecular formula C18H23ClN2O2 and a molecular weight of 334.85 g/mol. Its IUPAC name is 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide
PubChem CID1072799
Molecular FormulaC18H23ClN2O2
Molecular Weight334.85 g/mol
Exact Mass334.14
IUPAC Name1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide
SMILESO=C(NC1CCCC1)C1CCN(C(=O)c2ccccc2Cl)CC1
InChIInChI=1S/C18H23ClN2O2/c19-16-8-4-3-7-15(16)18(23)21-11-9-13(10-12-21)17(22)20-14-5-1-2-6-14/h3-4,7-8,13-14H,1-2,5-6,9-12H2,(H,20,22)
InChIKeyZESQELMUWGRXLO-UHFFFAOYSA-N
XLogP3.25
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.85
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-2-chlorobenzamide
CID 347041
2-Chloro-N-phenethyl-benzamide
CID 692233
Z944
CID 44540045
Benzamide, N-(3R)-1-azabicyclo(2.2.2)oct-3-yl-4-chloro-, hydrochloride (1:1)
CID 11243536
3-Chloro-N-(3-quinuclidinyl)benzamide
CID 2802540
N-(1-benzyl-4-piperidinyl)-2,4-dichlorobenzamide
CID 1069892
1-(3-Chlorobenzoyl)piperazine
CID 1074765
1-(2-Chloro-benzoyl)-piperazine
CID 2060585
N-Benzyl-2-chloro-benzamide
CID 347073
2,6-Dichloro-N-[1-(1-methylethyl)-4-piperidinyl]benzamide
CID 25236799
Benzamide derivative 11
CID 41306362
2,6-dichloro-N-(2-oxo-1H-pyridin-4-yl)benzamide
CID 59618445

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide?
The IUPAC name of 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide (CID 1072799) is 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide?
The canonical SMILES for 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide is O=C(NC1CCCC1)C1CCN(C(=O)c2ccccc2Cl)CC1.
What is the InChIKey of 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide?
The InChIKey is ZESQELMUWGRXLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23ClN2O2/c19-16-8-4-3-7-15(16)18(23)21-11-9-13(10-12-21)17(22)20-14-5-1-2-6-14/h3-4,7-8,13-14H,1-2,5-6,9-12H2,(H,20,22).
What are the key properties of 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide?
1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide has a molecular weight of 334.85 g/mol, XLogP of 3.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide is sourced from PubChem (CID 1072799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).