(3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide

C23H32N2O2 — CID 51954362

IUPAC(3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide
SMILESO=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2ccc(C3CCCCC3)cc2)C1
InChIInChI=1S/C23H32N2O2/c26-22(24-15-17-8-9-17)21-7-4-14-25(16-21)23(27)20-12-10-19(11-13-20)18-5-2-1-3-6-18/h10-13,17-18,21H,1-9,14-16H2,(H,24,26)/t21-/m1/s1
InChIKeyPGVZVPLYUCPYKE-OAQYLSRUSA-N
MW368.52 g/mol
LogP4.11
Rot. Bonds5

About (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide

(3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide (PubChem CID 51954362) has the molecular formula C23H32N2O2 and a molecular weight of 368.52 g/mol. Its IUPAC name is (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide
PubChem CID51954362
Molecular FormulaC23H32N2O2
Molecular Weight368.52 g/mol
Exact Mass368.25
IUPAC Name(3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide
SMILESO=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2ccc(C3CCCCC3)cc2)C1
InChIInChI=1S/C23H32N2O2/c26-22(24-15-17-8-9-17)21-7-4-14-25(16-21)23(27)20-12-10-19(11-13-20)18-5-2-1-3-6-18/h10-13,17-18,21H,1-9,14-16H2,(H,24,26)/t21-/m1/s1
InChIKeyPGVZVPLYUCPYKE-OAQYLSRUSA-N
XLogP4.11
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.52
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-(cyclohexylmethyl)-1-[4-(2,2-dimethylpropanoylamino)benzoyl]piperidine-3-carboxamide
CID 92728997
(4-cyclohexylphenyl)-pyrrolidin-1-ylmethanone
CID 78791688
(4-cyclohexylphenyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 119487583
(3R)-1-(4-chlorobenzoyl)-N-[(4-chlorophenyl)methyl]piperidine-3-carboxamide
CID 8713114
1-(4-fluorobenzoyl)-N-[(1-phenylpyrrolidin-3-yl)methyl]piperidine-3-carboxamide
CID 46403336
1-N-benzyl-3-N-(cyclohexylmethyl)piperidine-1,3-dicarboxamide
CID 43815765
1-(4-chlorobenzoyl)-N-ethylpiperidine-3-carboxamide
CID 47100006
N-[[4-(piperidine-1-carbonyl)phenyl]methyl]cyclopentanecarboxamide
CID 18119554
1-(4-fluorobenzoyl)-N-(oxolan-2-ylmethyl)piperidine-3-carboxamide
CID 18154535
(3S)-N-(cyclohexylmethyl)-1-[3-(methanesulfonamido)benzoyl]piperidine-3-carboxamide
CID 92729695
(4-cyclohexylphenyl)-(3-methylpyrrolidin-1-yl)methanone
CID 86877330
N-(cyclopropylmethyl)-1-(4,5-dichloro-1H-pyrrole-2-carbonyl)piperidine-3-carboxamide
CID 78882073

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide (CID 51954362) is (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide is O=C(NCC1CC1)[C@@H]1CCCN(C(=O)c2ccc(C3CCCCC3)cc2)C1.
What is the InChIKey of (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide?
The InChIKey is PGVZVPLYUCPYKE-OAQYLSRUSA-N. The full InChI is InChI=1S/C23H32N2O2/c26-22(24-15-17-8-9-17)21-7-4-14-25(16-21)23(27)20-12-10-19(11-13-20)18-5-2-1-3-6-18/h10-13,17-18,21H,1-9,14-16H2,(H,24,26)/t21-/m1/s1.
What are the key properties of (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide?
(3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide has a molecular weight of 368.52 g/mol, XLogP of 4.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(4-cyclohexylbenzoyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 51954362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).