3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide

C20H22N2O3 — CID 110394709

IUPAC3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide
SMILESCOc1ccc(C(=O)C2CCCN(C(=O)Nc3ccccc3)C2)cc1
InChIInChI=1S/C20H22N2O3/c1-25-18-11-9-15(10-12-18)19(23)16-6-5-13-22(14-16)20(24)21-17-7-3-2-4-8-17/h2-4,7-12,16H,5-6,13-14H2,1H3,(H,21,24)
InChIKeyFJHHQBIWYIWPRD-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.82
Rot. Bonds4

About 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide

3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide (PubChem CID 110394709) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide
PubChem CID110394709
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC Name3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide
SMILESCOc1ccc(C(=O)C2CCCN(C(=O)Nc3ccccc3)C2)cc1
InChIInChI=1S/C20H22N2O3/c1-25-18-11-9-15(10-12-18)19(23)16-6-5-13-22(14-16)20(24)21-17-7-3-2-4-8-17/h2-4,7-12,16H,5-6,13-14H2,1H3,(H,21,24)
InChIKeyFJHHQBIWYIWPRD-UHFFFAOYSA-N
XLogP3.82
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]-1-N-phenylpiperidine-1,3-dicarboxamide
CID 41036902
methyl 3-(4-methoxybenzoyl)piperidine-1-carboxylate
CID 110394724
cyclopentyl-[3-(4-methoxybenzoyl)piperidin-1-yl]methanone
CID 110394678
(3R)-3-(3-chlorobenzoyl)-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 25385725
[1-(2-methoxybenzoyl)piperidin-3-yl]-(4-methoxyphenyl)methanone
CID 110394690
N-(2,4-dimethoxyphenyl)-3-(6-methoxynaphthalene-2-carbonyl)piperidine-1-carboxamide
CID 45211600
(3R)-N-phenyl-3-(piperidine-1-carbonyl)piperidine-1-carboxamide
CID 8868811
methyl 4-[[(3R)-3-(2-methoxybenzoyl)piperidine-1-carbonyl]amino]benzoate
CID 42394704
3-benzoyl-N-(3-chlorophenyl)piperidine-1-carboxamide
CID 110394499
3-N-(6-methoxy-1,3-benzothiazol-2-yl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 17488727
(3R)-3-[(2S)-2-(2,4-dimethoxyphenyl)pyrrolidine-1-carbonyl]-N-phenylpiperidine-1-carboxamide
CID 40919247
N-(4-iodophenyl)-4-(4-methoxybenzoyl)piperidine-1-carboxamide
CID 112824394

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide (CID 110394709) is 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide is COc1ccc(C(=O)C2CCCN(C(=O)Nc3ccccc3)C2)cc1.
What is the InChIKey of 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide?
The InChIKey is FJHHQBIWYIWPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-25-18-11-9-15(10-12-18)19(23)16-6-5-13-22(14-16)20(24)21-17-7-3-2-4-8-17/h2-4,7-12,16H,5-6,13-14H2,1H3,(H,21,24).
What are the key properties of 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide?
3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxybenzoyl)-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 110394709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).