1-(4-phenoxybenzoyl)piperidine-3-carboxamide

C19H20N2O3 — CID 18159127

IUPAC1-(4-phenoxybenzoyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)c2ccc(Oc3ccccc3)cc2)C1
InChIInChI=1S/C19H20N2O3/c20-18(22)15-5-4-12-21(13-15)19(23)14-8-10-17(11-9-14)24-16-6-2-1-3-7-16/h1-3,6-11,15H,4-5,12-13H2,(H2,20,22)
InChIKeySZOOGPGKLNMFCX-UHFFFAOYSA-N
MW324.38 g/mol
LogP2.82
Rot. Bonds4

About 1-(4-phenoxybenzoyl)piperidine-3-carboxamide

1-(4-phenoxybenzoyl)piperidine-3-carboxamide (PubChem CID 18159127) has the molecular formula C19H20N2O3 and a molecular weight of 324.38 g/mol. Its IUPAC name is 1-(4-phenoxybenzoyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name1-(4-phenoxybenzoyl)piperidine-3-carboxamide
PubChem CID18159127
Molecular FormulaC19H20N2O3
Molecular Weight324.38 g/mol
Exact Mass324.15
IUPAC Name1-(4-phenoxybenzoyl)piperidine-3-carboxamide
SMILESNC(=O)C1CCCN(C(=O)c2ccc(Oc3ccccc3)cc2)C1
InChIInChI=1S/C19H20N2O3/c20-18(22)15-5-4-12-21(13-15)19(23)14-8-10-17(11-9-14)24-16-6-2-1-3-7-16/h1-3,6-11,15H,4-5,12-13H2,(H2,20,22)
InChIKeySZOOGPGKLNMFCX-UHFFFAOYSA-N
XLogP2.82
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-aminopiperidin-1-yl)-(4-phenoxyphenyl)methanone
CID 119377677
(4-phenoxyphenyl)-piperidin-1-ylmethanone
CID 112759363
(4-phenoxyphenyl)-[1-(pyridine-4-carbonyl)piperidin-3-yl]methanone
CID 45178915
[(3R)-3-hydroxypiperidin-1-yl]-(4-phenoxyphenyl)methanone
CID 51458046
(3S)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 68704612
(4-phenoxyphenyl)-[1-(pyridine-3-carbonyl)piperidin-3-yl]methanone
CID 45205792
(3S)-1-(6-phenoxypyridine-3-carbonyl)pyrrolidine-3-carboxamide
CID 94512813
[4-(4-phenoxybenzoyl)-1,4-diazepan-1-yl]-phenylmethanone
CID 36615147
[(3S)-1-(1-oxidopyridin-1-ium-3-carbonyl)piperidin-3-yl]-(4-phenoxyphenyl)methanone
CID 42147812
(4-phenoxyphenyl)-[3-(2H-triazol-4-yl)piperidin-1-yl]methanone
CID 166270023
1-benzoylpiperidine-3-carbonyl chloride
CID 15718173
2-methylsulfanyl-1-[(3R)-3-(4-phenoxybenzoyl)piperidin-1-yl]ethanone
CID 42306399

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenoxybenzoyl)piperidine-3-carboxamide?
The IUPAC name of 1-(4-phenoxybenzoyl)piperidine-3-carboxamide (CID 18159127) is 1-(4-phenoxybenzoyl)piperidine-3-carboxamide.
What is the SMILES notation for 1-(4-phenoxybenzoyl)piperidine-3-carboxamide?
The canonical SMILES for 1-(4-phenoxybenzoyl)piperidine-3-carboxamide is NC(=O)C1CCCN(C(=O)c2ccc(Oc3ccccc3)cc2)C1.
What is the InChIKey of 1-(4-phenoxybenzoyl)piperidine-3-carboxamide?
The InChIKey is SZOOGPGKLNMFCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3/c20-18(22)15-5-4-12-21(13-15)19(23)14-8-10-17(11-9-14)24-16-6-2-1-3-7-16/h1-3,6-11,15H,4-5,12-13H2,(H2,20,22).
What are the key properties of 1-(4-phenoxybenzoyl)piperidine-3-carboxamide?
1-(4-phenoxybenzoyl)piperidine-3-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 2.82, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenoxybenzoyl)piperidine-3-carboxamide is sourced from PubChem (CID 18159127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).