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

C19H25ClN2O2 — CID 1072829

IUPAC1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
SMILESO=C(NC1CCCCC1)C1CCN(C(=O)c2ccccc2Cl)CC1
InChIInChI=1S/C19H25ClN2O2/c20-17-9-5-4-8-16(17)19(24)22-12-10-14(11-13-22)18(23)21-15-6-2-1-3-7-15/h4-5,8-9,14-15H,1-3,6-7,10-13H2,(H,21,23)
InChIKeySKJYXZJKKOGDTG-UHFFFAOYSA-N
MW348.87 g/mol
LogP3.64
Rot. Bonds3

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

1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide (PubChem CID 1072829) has the molecular formula C19H25ClN2O2 and a molecular weight of 348.87 g/mol. Its IUPAC name is 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
PubChem CID1072829
Molecular FormulaC19H25ClN2O2
Molecular Weight348.87 g/mol
Exact Mass348.16
IUPAC Name1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
SMILESO=C(NC1CCCCC1)C1CCN(C(=O)c2ccccc2Cl)CC1
InChIInChI=1S/C19H25ClN2O2/c20-17-9-5-4-8-16(17)19(24)22-12-10-14(11-13-22)18(23)21-15-6-2-1-3-7-15/h4-5,8-9,14-15H,1-3,6-7,10-13H2,(H,21,23)
InChIKeySKJYXZJKKOGDTG-UHFFFAOYSA-N
XLogP3.64
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.87
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-chlorobenzoyl)-N-cyclopentylpiperidine-4-carboxamide
CID 1072799
N-cycloheptyl-1-(2-fluorobenzoyl)piperidine-4-carboxamide
CID 17019024
1-(2-chlorobenzoyl)-N-[2-(cyclohexylcarbamoyl)phenyl]piperidine-4-carboxamide
CID 17223536
N-cyclohexyl-1-(naphthalene-1-carbonyl)piperidine-4-carboxamide
CID 18108639
N-[1-(2-fluorobenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820345
N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 51096408
1-(2-chloro-6-fluorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide
CID 113003080
2-[4-(cyclopropanecarbonylamino)piperidine-1-carbonyl]benzoic acid
CID 113083284
N-[1-(2-methoxybenzoyl)piperidin-4-yl]cyclohexanecarboxamide
CID 110820511
N-cycloheptyl-1-[2-(2-methylphenyl)pyridine-3-carbonyl]piperidine-4-carboxamide
CID 46390267
N-[1-(2-methylbenzoyl)piperidin-4-yl]cyclobutanecarboxamide
CID 110820253
(2-chlorophenyl)-[4-(methylamino)piperidin-1-yl]methanone
CID 83728656

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide?
The IUPAC name of 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide (CID 1072829) is 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide?
The canonical SMILES for 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide is O=C(NC1CCCCC1)C1CCN(C(=O)c2ccccc2Cl)CC1.
What is the InChIKey of 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide?
The InChIKey is SKJYXZJKKOGDTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25ClN2O2/c20-17-9-5-4-8-16(17)19(24)22-12-10-14(11-13-22)18(23)21-15-6-2-1-3-7-15/h4-5,8-9,14-15H,1-3,6-7,10-13H2,(H,21,23).
What are the key properties of 1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide?
1-(2-chlorobenzoyl)-N-cyclohexylpiperidine-4-carboxamide has a molecular weight of 348.87 g/mol, XLogP of 3.64, 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-cyclohexylpiperidine-4-carboxamide is sourced from PubChem (CID 1072829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).