2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone

C16H15FO2 — CID 113453726

IUPAC2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone
SMILESCOc1cccc(CC(=O)c2ccccc2C)c1F
InChIInChI=1S/C16H15FO2/c1-11-6-3-4-8-13(11)14(18)10-12-7-5-9-15(19-2)16(12)17/h3-9H,10H2,1-2H3
InChIKeyWQHVQLLGNQECCR-UHFFFAOYSA-N
MW258.29 g/mol
LogP3.57
Rot. Bonds4

About 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone

2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone (PubChem CID 113453726) has the molecular formula C16H15FO2 and a molecular weight of 258.29 g/mol. Its IUPAC name is 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone
PubChem CID113453726
Molecular FormulaC16H15FO2
Molecular Weight258.29 g/mol
Exact Mass258.11
IUPAC Name2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone
SMILESCOc1cccc(CC(=O)c2ccccc2C)c1F
InChIInChI=1S/C16H15FO2/c1-11-6-3-4-8-13(11)14(18)10-12-7-5-9-15(19-2)16(12)17/h3-9H,10H2,1-2H3
InChIKeyWQHVQLLGNQECCR-UHFFFAOYSA-N
XLogP3.57
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.29
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-aminophenyl)-2-(2-fluoro-3-methoxyphenyl)ethanone
CID 113453735
1-(2,5-difluorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethanone
CID 104793432
1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanone
CID 62790793
1-(2,5-dimethylfuran-3-yl)-2-(2-fluoro-3-methoxyphenyl)ethanone
CID 115800291
1,2-bis(2-methylphenyl)ethanone
CID 11345119
1-(2-bromo-5-fluorophenyl)-2-(2-fluoro-3-methoxyphenyl)ethanone
CID 115800218
2-(2-fluoro-3-methoxyphenyl)-1-(3-methoxy-4-pyridinyl)ethanone
CID 105065080
1-(2-fluoro-3-methoxyphenyl)-3-(2-methylphenyl)sulfanylpropan-2-one
CID 104793477
1-(2-fluoro-3-methoxyphenyl)-N-[(2-methylphenyl)methyl]methanamine
CID 104791604
2-(2-fluoro-3-methoxyphenyl)-1-(4-methoxyphenyl)ethanone
CID 104793354
2-(2-fluoro-3-methoxyphenyl)-1-(5-methylpyrimidin-2-yl)ethanone
CID 113453750
1-(2-chloro-3-fluorophenyl)-2-(2-methoxyphenyl)ethanone
CID 81453841

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone?
The IUPAC name of 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone (CID 113453726) is 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone.
What is the SMILES notation for 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone?
The canonical SMILES for 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone is COc1cccc(CC(=O)c2ccccc2C)c1F.
What is the InChIKey of 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone?
The InChIKey is WQHVQLLGNQECCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FO2/c1-11-6-3-4-8-13(11)14(18)10-12-7-5-9-15(19-2)16(12)17/h3-9H,10H2,1-2H3.
What are the key properties of 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone?
2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone has a molecular weight of 258.29 g/mol, XLogP of 3.57, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-3-methoxyphenyl)-1-(2-methylphenyl)ethanone is sourced from PubChem (CID 113453726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).