2-benzoyl-3-phenyl-1H-quinolin-4-one

C22H15NO2 — CID 132534400

IUPAC2-benzoyl-3-phenyl-1H-quinolin-4-one
SMILESO=C(c1ccccc1)c1[nH]c2ccccc2c(=O)c1-c1ccccc1
InChIInChI=1S/C22H15NO2/c24-21(16-11-5-2-6-12-16)20-19(15-9-3-1-4-10-15)22(25)17-13-7-8-14-18(17)23-20/h1-14H,(H,23,25)
InChIKeySGZMTYSXWIPZMN-UHFFFAOYSA-N
MW325.37 g/mol
LogP4.43
Rot. Bonds3

About 2-benzoyl-3-phenyl-1H-quinolin-4-one

2-benzoyl-3-phenyl-1H-quinolin-4-one (PubChem CID 132534400) has the molecular formula C22H15NO2 and a molecular weight of 325.37 g/mol. Its IUPAC name is 2-benzoyl-3-phenyl-1H-quinolin-4-one.

Molecular Properties

Compound Name2-benzoyl-3-phenyl-1H-quinolin-4-one
PubChem CID132534400
Molecular FormulaC22H15NO2
Molecular Weight325.37 g/mol
Exact Mass325.11
IUPAC Name2-benzoyl-3-phenyl-1H-quinolin-4-one
SMILESO=C(c1ccccc1)c1[nH]c2ccccc2c(=O)c1-c1ccccc1
InChIInChI=1S/C22H15NO2/c24-21(16-11-5-2-6-12-16)20-19(15-9-3-1-4-10-15)22(25)17-13-7-8-14-18(17)23-20/h1-14H,(H,23,25)
InChIKeySGZMTYSXWIPZMN-UHFFFAOYSA-N
XLogP4.43
TPSA49.93 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-benzoyl-3-(4-chlorophenyl)-1H-quinolin-4-one
CID 132534397
3-benzoyl-1H-indole-2-carboxylic acid
CID 22917099
(3-ethenyl-1H-indol-2-yl)-phenylmethanone
CID 102499335
2-(4-fluorophenyl)-3-phenyl-1H-quinolin-4-one
CID 19067574
4-amino-3-benzoyl-1H-quinolin-2-one
CID 11737142
(2-fluoro-1H-indol-3-yl)-phenylmethanone
CID 175455866
10H-acridin-9-one
CID 22753806
benzoic acid;9H-carbazole
CID 162147282
3-benzoyl-4-phenylchromen-2-one
CID 629843
9H-carbazole;9,10-diphenylanthracene
CID 159841164
[5-amino-3-(3-bromophenyl)-4-(2-methyl-1H-indole-3-carbonyl)-1H-pyrrol-2-yl]-phenylmethanone
CID 70698470
bis(3-hydroxy-1H-indol-2-yl)methanone
CID 151180929

Frequently Asked Questions

What is the IUPAC name of 2-benzoyl-3-phenyl-1H-quinolin-4-one?
The IUPAC name of 2-benzoyl-3-phenyl-1H-quinolin-4-one (CID 132534400) is 2-benzoyl-3-phenyl-1H-quinolin-4-one.
What is the SMILES notation for 2-benzoyl-3-phenyl-1H-quinolin-4-one?
The canonical SMILES for 2-benzoyl-3-phenyl-1H-quinolin-4-one is O=C(c1ccccc1)c1[nH]c2ccccc2c(=O)c1-c1ccccc1.
What is the InChIKey of 2-benzoyl-3-phenyl-1H-quinolin-4-one?
The InChIKey is SGZMTYSXWIPZMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15NO2/c24-21(16-11-5-2-6-12-16)20-19(15-9-3-1-4-10-15)22(25)17-13-7-8-14-18(17)23-20/h1-14H,(H,23,25).
What are the key properties of 2-benzoyl-3-phenyl-1H-quinolin-4-one?
2-benzoyl-3-phenyl-1H-quinolin-4-one has a molecular weight of 325.37 g/mol, XLogP of 4.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzoyl-3-phenyl-1H-quinolin-4-one is sourced from PubChem (CID 132534400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).