1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one

C17H18O2 — CID 82120149

IUPAC1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one
SMILESCOc1ccccc1-c1cccc(C(=O)C(C)C)c1
InChIInChI=1S/C17H18O2/c1-12(2)17(18)14-8-6-7-13(11-14)15-9-4-5-10-16(15)19-3/h4-12H,1-3H3
InChIKeyYUHWJXPSDXUMED-UHFFFAOYSA-N
MW254.33 g/mol
LogP4.20
Rot. Bonds4

About 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one

1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one (PubChem CID 82120149) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one.

Molecular Properties

Compound Name1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one
PubChem CID82120149
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one
SMILESCOc1ccccc1-c1cccc(C(=O)C(C)C)c1
InChIInChI=1S/C17H18O2/c1-12(2)17(18)14-8-6-7-13(11-14)15-9-4-5-10-16(15)19-3/h4-12H,1-3H3
InChIKeyYUHWJXPSDXUMED-UHFFFAOYSA-N
XLogP4.20
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one 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

3-(2-methoxyphenyl)benzoic acid
CID 2759547
methyl (E)-3-[3-(2-methoxyphenyl)phenyl]but-2-enoate
CID 82543553
2-[[3-(2-methoxyphenyl)benzoyl]-[(2-propan-2-yloxyphenyl)methyl]amino]acetic acid
CID 129454644
1-(3,4-dimethoxyphenyl)-2-methylpropan-1-one
CID 26422
[(3R,4R)-3-fluoro-4-hydroxypyrrolidin-1-yl]-[3-(2-methoxyphenyl)phenyl]methanone
CID 131945890
3-(2-fluoro-3-methoxyphenyl)benzoic acid
CID 53216650
[4-(2-fluorobenzoyl)piperazin-1-yl]-[3-(2-methoxyphenyl)phenyl]methanone
CID 134800061
3-hydroxy-5-(2-methoxyphenyl)benzoic acid
CID 53225397
2-(4-methoxyphenyl)-1-[4-[3-(2-methoxyphenyl)benzoyl]piperazin-1-yl]ethanone
CID 134802866
2-[(2-chlorophenyl)methyl-[3-(2-methoxyphenyl)benzoyl]amino]acetic acid
CID 110165690
2-[[3-(2-methoxyphenyl)benzoyl]-[(4-propan-2-yloxyphenyl)methyl]amino]acetic acid
CID 129455176
[3-(3-methoxyphenoxy)azetidin-1-yl]-[3-(2-methoxyphenyl)phenyl]methanone
CID 131920038

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one?
The IUPAC name of 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one (CID 82120149) is 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one.
What is the SMILES notation for 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one?
The canonical SMILES for 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one is COc1ccccc1-c1cccc(C(=O)C(C)C)c1.
What is the InChIKey of 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one?
The InChIKey is YUHWJXPSDXUMED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-12(2)17(18)14-8-6-7-13(11-14)15-9-4-5-10-16(15)19-3/h4-12H,1-3H3.
What are the key properties of 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one?
1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one has a molecular weight of 254.33 g/mol, XLogP of 4.20, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methoxyphenyl)phenyl]-2-methylpropan-1-one is sourced from PubChem (CID 82120149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).