1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide

C25H30N2O4 — CID 86901250

IUPAC1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide
SMILESCOc1ccc(NC(=O)C2CCCN(C(=O)c3ccccc3)C2)cc1OC1CCCC1
InChIInChI=1S/C25H30N2O4/c1-30-22-14-13-20(16-23(22)31-21-11-5-6-12-21)26-24(28)19-10-7-15-27(17-19)25(29)18-8-3-2-4-9-18/h2-4,8-9,13-14,16,19,21H,5-7,10-12,15,17H2,1H3,(H,26,28)
InChIKeyVVKSWCFIBASIEZ-UHFFFAOYSA-N
MW422.53 g/mol
LogP4.51
Rot. Bonds6

About 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide

1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide (PubChem CID 86901250) has the molecular formula C25H30N2O4 and a molecular weight of 422.53 g/mol. Its IUPAC name is 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide
PubChem CID86901250
Molecular FormulaC25H30N2O4
Molecular Weight422.53 g/mol
Exact Mass422.22
IUPAC Name1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide
SMILESCOc1ccc(NC(=O)C2CCCN(C(=O)c3ccccc3)C2)cc1OC1CCCC1
InChIInChI=1S/C25H30N2O4/c1-30-22-14-13-20(16-23(22)31-21-11-5-6-12-21)26-24(28)19-10-7-15-27(17-19)25(29)18-8-3-2-4-9-18/h2-4,8-9,13-14,16,19,21H,5-7,10-12,15,17H2,1H3,(H,26,28)
InChIKeyVVKSWCFIBASIEZ-UHFFFAOYSA-N
XLogP4.51
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.53
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-cyclopentyloxy-4-methoxyphenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55584917
1-butanoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide
CID 55913400
1-(benzenesulfonyl)-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-2-carboxamide
CID 55584183
(3R)-N-(3,4-dimethoxyphenyl)-1-methylpiperidine-3-carboxamide
CID 96595344
N-(3-cyclopentyloxy-4-methoxyphenyl)-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide
CID 46424838
1-benzoyl-N-(3-tert-butylphenyl)piperidine-3-carboxamide
CID 121381993
1-(4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoyl)-N-phenylpiperidine-3-carboxamide
CID 42924927
(3S)-3-N-(3-chloro-4-methoxyphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 26586333
N-(3-cyclopentyloxy-4-methoxyphenyl)-1-(3-phenylpropyl)piperidine-4-carboxamide
CID 110194127
1-benzyl-N-(3-cyclopentyloxy-4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 46402015
N-(2-aminoethyl)-1-(4-cyclopentyloxy-3-methoxybenzoyl)piperidine-3-carboxamide
CID 119480695
(3R)-1-(4-methoxynaphthalene-1-carbonyl)-N-phenylpiperidine-3-carboxamide
CID 25493135

Frequently Asked Questions

What is the IUPAC name of 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide?
The IUPAC name of 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide (CID 86901250) is 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide?
The canonical SMILES for 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide is COc1ccc(NC(=O)C2CCCN(C(=O)c3ccccc3)C2)cc1OC1CCCC1.
What is the InChIKey of 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide?
The InChIKey is VVKSWCFIBASIEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2O4/c1-30-22-14-13-20(16-23(22)31-21-11-5-6-12-21)26-24(28)19-10-7-15-27(17-19)25(29)18-8-3-2-4-9-18/h2-4,8-9,13-14,16,19,21H,5-7,10-12,15,17H2,1H3,(H,26,28).
What are the key properties of 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide?
1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide has a molecular weight of 422.53 g/mol, XLogP of 4.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzoyl-N-(3-cyclopentyloxy-4-methoxyphenyl)piperidine-3-carboxamide is sourced from PubChem (CID 86901250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).