1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide

C21H29N3O3 — CID 51272766

IUPAC1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide
SMILESCC(=O)NC(C(=O)N1CCC(C(=O)Nc2ccccc2)CC1)C1CCCC1
InChIInChI=1S/C21H29N3O3/c1-15(25)22-19(16-7-5-6-8-16)21(27)24-13-11-17(12-14-24)20(26)23-18-9-3-2-4-10-18/h2-4,9-10,16-17,19H,5-8,11-14H2,1H3,(H,22,25)(H,23,26)
InChIKeyFMNRMPYQEXYCIC-UHFFFAOYSA-N
MW371.48 g/mol
LogP2.56
Rot. Bonds5

About 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide

1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide (PubChem CID 51272766) has the molecular formula C21H29N3O3 and a molecular weight of 371.48 g/mol. Its IUPAC name is 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide
PubChem CID51272766
Molecular FormulaC21H29N3O3
Molecular Weight371.48 g/mol
Exact Mass371.22
IUPAC Name1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide
SMILESCC(=O)NC(C(=O)N1CCC(C(=O)Nc2ccccc2)CC1)C1CCCC1
InChIInChI=1S/C21H29N3O3/c1-15(25)22-19(16-7-5-6-8-16)21(27)24-13-11-17(12-14-24)20(26)23-18-9-3-2-4-10-18/h2-4,9-10,16-17,19H,5-8,11-14H2,1H3,(H,22,25)(H,23,26)
InChIKeyFMNRMPYQEXYCIC-UHFFFAOYSA-N
XLogP2.56
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.48
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-cyclopentyl-2-oxo-2-[4-(phenoxymethyl)piperidin-1-yl]ethyl]acetamide
CID 167912458
N-(4-acetamidophenyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 31669191
1-(1-oxo-1-piperidin-1-ylpropan-2-yl)-N-phenylpiperidine-4-carboxamide
CID 78817808
1-(2-amino-3-phenylpropanoyl)-N-phenylpiperidine-4-carboxamide;hydrochloride
CID 119272890
N-[1-cyclopentyl-2-[4-(4-hydroxyphenyl)piperidin-1-yl]-2-oxoethyl]acetamide
CID 78846216
1-[(2R)-2-(4-fluorophenoxy)propanoyl]-N-phenylpiperidine-4-carboxamide
CID 41499825
1-[(2S)-1-(cyclopentylamino)-1-oxopropan-2-yl]-N-phenylpiperidine-4-carboxamide
CID 30795732
1-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]-N-phenylpiperidine-4-carboxamide
CID 9134665
N-phenyl-1-(3-phenylbutanoyl)piperidine-4-carboxamide
CID 17409720
1-(2-acetamido-3-methylbutanoyl)-N-pyridin-4-ylpiperidine-4-carboxamide
CID 47026893
4-(4-acetylpiperazine-1-carbonyl)-N-phenylcyclohexane-1-carboxamide
CID 109147706
1-(4-tert-butylbenzoyl)-N-phenylpiperidine-4-carboxamide
CID 113006047

Frequently Asked Questions

What is the IUPAC name of 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide?
The IUPAC name of 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide (CID 51272766) is 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide?
The canonical SMILES for 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide is CC(=O)NC(C(=O)N1CCC(C(=O)Nc2ccccc2)CC1)C1CCCC1.
What is the InChIKey of 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide?
The InChIKey is FMNRMPYQEXYCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O3/c1-15(25)22-19(16-7-5-6-8-16)21(27)24-13-11-17(12-14-24)20(26)23-18-9-3-2-4-10-18/h2-4,9-10,16-17,19H,5-8,11-14H2,1H3,(H,22,25)(H,23,26).
What are the key properties of 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide?
1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide has a molecular weight of 371.48 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-acetamido-2-cyclopentylacetyl)-N-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 51272766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).