2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone

C20H21NO2 — CID 670679

IUPAC2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone
SMILESO=C(Cc1ccccc1)c1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C20H21NO2/c22-19(15-16-9-3-1-4-10-16)17-11-5-6-12-18(17)20(23)21-13-7-2-8-14-21/h1,3-6,9-12H,2,7-8,13-15H2
InChIKeyGTZQHATUPRUOGY-UHFFFAOYSA-N
MW307.39 g/mol
LogP3.74
Rot. Bonds4

About 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone

2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone (PubChem CID 670679) has the molecular formula C20H21NO2 and a molecular weight of 307.39 g/mol. Its IUPAC name is 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone.

Molecular Properties

Compound Name2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone
PubChem CID670679
Molecular FormulaC20H21NO2
Molecular Weight307.39 g/mol
Exact Mass307.16
IUPAC Name2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone
SMILESO=C(Cc1ccccc1)c1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C20H21NO2/c22-19(15-16-9-3-1-4-10-16)17-11-5-6-12-18(17)20(23)21-13-7-2-8-14-21/h1,3-6,9-12H,2,7-8,13-15H2
InChIKeyGTZQHATUPRUOGY-UHFFFAOYSA-N
XLogP3.74
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.39
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone?
The IUPAC name of 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone (CID 670679) is 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone.
What is the SMILES notation for 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone?
The canonical SMILES for 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone is O=C(Cc1ccccc1)c1ccccc1C(=O)N1CCCCC1.
What is the InChIKey of 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone?
The InChIKey is GTZQHATUPRUOGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21NO2/c22-19(15-16-9-3-1-4-10-16)17-11-5-6-12-18(17)20(23)21-13-7-2-8-14-21/h1,3-6,9-12H,2,7-8,13-15H2.
What are the key properties of 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone?
2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone has a molecular weight of 307.39 g/mol, XLogP of 3.74, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-[2-(piperidine-1-carbonyl)phenyl]ethanone is sourced from PubChem (CID 670679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).