(5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone

C25H23NO2 — CID 68879939

IUPAC(5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone
SMILESO=C(c1ccccc1)C1CNCC(C(=O)c2ccccc2)C1c1ccccc1
InChIInChI=1S/C25H23NO2/c27-24(19-12-6-2-7-13-19)21-16-26-17-22(23(21)18-10-4-1-5-11-18)25(28)20-14-8-3-9-15-20/h1-15,21-23,26H,16-17H2
InChIKeyLQMHOANHRINOHS-UHFFFAOYSA-N
MW369.46 g/mol
LogP4.37
Rot. Bonds5

About (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone

(5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone (PubChem CID 68879939) has the molecular formula C25H23NO2 and a molecular weight of 369.46 g/mol. Its IUPAC name is (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone.

Molecular Properties

Compound Name(5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone
PubChem CID68879939
Molecular FormulaC25H23NO2
Molecular Weight369.46 g/mol
Exact Mass369.17
IUPAC Name(5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone
SMILESO=C(c1ccccc1)C1CNCC(C(=O)c2ccccc2)C1c1ccccc1
InChIInChI=1S/C25H23NO2/c27-24(19-12-6-2-7-13-19)21-16-26-17-22(23(21)18-10-4-1-5-11-18)25(28)20-14-8-3-9-15-20/h1-15,21-23,26H,16-17H2
InChIKeyLQMHOANHRINOHS-UHFFFAOYSA-N
XLogP4.37
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.46
LogP ≤ 54.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Phenyl(piperidin-4-yl)methanone
CID 226102
Cambridge id 5314153
CID 2841053
1,2-Diphenyl-3-(1-piperidinyl)-1-propanone
CID 89341
4-Biphenylyl(1-methyl-3-piperidinyl)methanone
CID 23723212
Phenyl-[1-(4-phenyl-butyl)-piperidin-4-yl]-methanone
CID 10018996
3-acetyl-N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]benzamide
CID 11364721
1-Phenyl-3-(4-phenyl-piperidin-1-yl)-propan-1-one
CID 14970538
5-oxo-5-phenyl-N-(2-phenylethyl)pentanamide
CID 20969092
4-(4-(p-Fluorobenzoyl)piperidino)-4'-fluorobutyrophenone hydrochloride
CID 32592
4-Benzoylpiperidine hydrochloride
CID 2724437
c2-(1-Benzyl-piperidin-4-yl)-1-biphenyl-4-yl-ethanone
CID 10317034
3-(4-biphenylylcarbonyl)-N-ethyl-1-piperidinecarboxamide
CID 23723782

Frequently Asked Questions

What is the IUPAC name of (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone?
The IUPAC name of (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone (CID 68879939) is (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone.
What is the SMILES notation for (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone?
The canonical SMILES for (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone is O=C(c1ccccc1)C1CNCC(C(=O)c2ccccc2)C1c1ccccc1.
What is the InChIKey of (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone?
The InChIKey is LQMHOANHRINOHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23NO2/c27-24(19-12-6-2-7-13-19)21-16-26-17-22(23(21)18-10-4-1-5-11-18)25(28)20-14-8-3-9-15-20/h1-15,21-23,26H,16-17H2.
What are the key properties of (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone?
(5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone has a molecular weight of 369.46 g/mol, XLogP of 4.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-benzoyl-4-phenylpiperidin-3-yl)-phenylmethanone is sourced from PubChem (CID 68879939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).