1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone

C24H19NO — CID 135034333

IUPAC1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone
SMILESCc1ccccc1C(=O)Cc1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C24H19NO/c1-17-9-5-6-12-20(17)24(26)16-19-15-23(18-10-3-2-4-11-18)25-22-14-8-7-13-21(19)22/h2-15H,16H2,1H3
InChIKeyPVNUURSBWOILFL-UHFFFAOYSA-N
MW337.42 g/mol
LogP5.64
Rot. Bonds4

About 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone

1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone (PubChem CID 135034333) has the molecular formula C24H19NO and a molecular weight of 337.42 g/mol. Its IUPAC name is 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone.

Molecular Properties

Compound Name1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone
PubChem CID135034333
Molecular FormulaC24H19NO
Molecular Weight337.42 g/mol
Exact Mass337.15
IUPAC Name1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone
SMILESCc1ccccc1C(=O)Cc1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C24H19NO/c1-17-9-5-6-12-20(17)24(26)16-19-15-23(18-10-3-2-4-11-18)25-22-14-8-7-13-21(19)22/h2-15H,16H2,1H3
InChIKeyPVNUURSBWOILFL-UHFFFAOYSA-N
XLogP5.64
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.42
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(2-methylbenzoyl)amino]ethyl]-2-phenylquinoline-4-carboxamide
CID 8991019
4-QUINOLINECARBOXYLIC ACID, 2-PHENYL-, SODIUM SALT (1:1)
CID 167996008
1-naphthalen-2-yl-2-(2-phenylquinolin-4-yl)ethanone
CID 135034335
N-(2-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 769490
europium;2-phenylquinoline-4-carboxylic acid
CID 87730786
[2-(2,5-dimethylphenyl)-2-oxoethyl] 2-(4-phenylphenyl)quinoline-4-carboxylate
CID 3497845
2-phenylquinoline-4-carboxylic acid;prop-1-ene
CID 143187114
ethanol;bis(europium(3+));hexakis(2-phenylquinoline-4-carboxylate)
CID 139141812
2-(1-methylazetidin-3-yl)-1-(2-phenylquinolin-4-yl)ethanone
CID 160950285
1-(2-phenylquinolin-4-yl)heptan-1-one
CID 159379638
deuterio-(2-phenylquinolin-4-yl)methanol
CID 88591215
sodium (2-phenylquinoline-4-carbonyl)azanide
CID 140991412

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone?
The IUPAC name of 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone (CID 135034333) is 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone.
What is the SMILES notation for 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone?
The canonical SMILES for 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone is Cc1ccccc1C(=O)Cc1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone?
The InChIKey is PVNUURSBWOILFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO/c1-17-9-5-6-12-20(17)24(26)16-19-15-23(18-10-3-2-4-11-18)25-22-14-8-7-13-21(19)22/h2-15H,16H2,1H3.
What are the key properties of 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone?
1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone has a molecular weight of 337.42 g/mol, XLogP of 5.64, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenyl)-2-(2-phenylquinolin-4-yl)ethanone is sourced from PubChem (CID 135034333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).