N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide

C25H30N2O3 — CID 46333939

IUPACN-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide
SMILESCOc1ccc(C(=O)N2CCCC(c3cccc(C(=O)NC4CCCC4)c3)C2)cc1
InChIInChI=1S/C25H30N2O3/c1-30-23-13-11-18(12-14-23)25(29)27-15-5-8-21(17-27)19-6-4-7-20(16-19)24(28)26-22-9-2-3-10-22/h4,6-7,11-14,16,21-22H,2-3,5,8-10,15,17H2,1H3,(H,26,28)
InChIKeyHPISTWPBIBIKJJ-UHFFFAOYSA-N
MW406.53 g/mol
LogP4.39
Rot. Bonds5

About N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide

N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide (PubChem CID 46333939) has the molecular formula C25H30N2O3 and a molecular weight of 406.53 g/mol. Its IUPAC name is N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide
PubChem CID46333939
Molecular FormulaC25H30N2O3
Molecular Weight406.53 g/mol
Exact Mass406.23
IUPAC NameN-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide
SMILESCOc1ccc(C(=O)N2CCCC(c3cccc(C(=O)NC4CCCC4)c3)C2)cc1
InChIInChI=1S/C25H30N2O3/c1-30-23-13-11-18(12-14-23)25(29)27-15-5-8-21(17-27)19-6-4-7-20(16-19)24(28)26-22-9-2-3-10-22/h4,6-7,11-14,16,21-22H,2-3,5,8-10,15,17H2,1H3,(H,26,28)
InChIKeyHPISTWPBIBIKJJ-UHFFFAOYSA-N
XLogP4.39
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.53
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-3-[1-(4-ethylbenzoyl)piperidin-3-yl]benzamide
CID 46333971
N-cyclopentyl-3-[(3R)-1-(4-ethylbenzoyl)piperidin-3-yl]benzamide
CID 92872382
N-butyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide
CID 46333958
N-cyclopropyl-3-[[(3R)-1-(4-methoxybenzoyl)piperidin-3-yl]methoxy]benzamide
CID 92901057
3-[(3S)-1-(4-methoxybenzoyl)piperidin-3-yl]-N-[(2-methoxyphenyl)methyl]benzamide
CID 92872341
N-[(3-chlorophenyl)methyl]-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide
CID 46333937
N-[(3-chlorophenyl)methyl]-3-[(3R)-1-(4-methoxybenzoyl)piperidin-3-yl]benzamide
CID 92872314
3-[3-(cyclohexylcarbamoyl)phenyl]-N-ethylpiperidine-1-carboxamide
CID 50788931
3-[3-(cycloheptylcarbamoyl)phenyl]-N-(4-ethoxyphenyl)piperidine-1-carboxamide
CID 46334034
3-[3-(cyclopropylcarbamoyl)phenyl]-N-propan-2-ylpiperidine-1-carboxamide
CID 50789048
(3S)-3-[3-[(4-methoxyphenyl)methylcarbamoyl]phenyl]-N-methylpiperidine-1-carboxamide
CID 92890941
(3-methoxyphenyl)-[(3R)-3-phenylpiperidin-1-yl]methanone
CID 740543

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide?
The IUPAC name of N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide (CID 46333939) is N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide.
What is the SMILES notation for N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide?
The canonical SMILES for N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide is COc1ccc(C(=O)N2CCCC(c3cccc(C(=O)NC4CCCC4)c3)C2)cc1.
What is the InChIKey of N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide?
The InChIKey is HPISTWPBIBIKJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2O3/c1-30-23-13-11-18(12-14-23)25(29)27-15-5-8-21(17-27)19-6-4-7-20(16-19)24(28)26-22-9-2-3-10-22/h4,6-7,11-14,16,21-22H,2-3,5,8-10,15,17H2,1H3,(H,26,28).
What are the key properties of N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide?
N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide has a molecular weight of 406.53 g/mol, XLogP of 4.39, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[1-(4-methoxybenzoyl)piperidin-3-yl]benzamide is sourced from PubChem (CID 46333939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).