2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone

C16H15FO2 — CID 43379558

IUPAC2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone
SMILESCOc1ccc(C(=O)Cc2cccc(F)c2)cc1C
InChIInChI=1S/C16H15FO2/c1-11-8-13(6-7-16(11)19-2)15(18)10-12-4-3-5-14(17)9-12/h3-9H,10H2,1-2H3
InChIKeyZNTRURVQVMRAEV-UHFFFAOYSA-N
MW258.29 g/mol
LogP3.57
Rot. Bonds4

About 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone

2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone (PubChem CID 43379558) has the molecular formula C16H15FO2 and a molecular weight of 258.29 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone
PubChem CID43379558
Molecular FormulaC16H15FO2
Molecular Weight258.29 g/mol
Exact Mass258.11
IUPAC Name2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone
SMILESCOc1ccc(C(=O)Cc2cccc(F)c2)cc1C
InChIInChI=1S/C16H15FO2/c1-11-8-13(6-7-16(11)19-2)15(18)10-12-4-3-5-14(17)9-12/h3-9H,10H2,1-2H3
InChIKeyZNTRURVQVMRAEV-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-(3-fluorophenyl)-1-(4-methoxy-3-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-(4-methoxy-3-methylphenyl)-2-(3-methoxyphenyl)ethanone
CID 43379572
2-(3-fluorophenyl)-1-(3-methoxyphenyl)ethanone
CID 60797583
1-(3-fluoro-4-methoxyphenyl)-2-(3-methylphenyl)ethanone
CID 62389398
2-(3-fluorophenyl)-1-(3-methyl-4-nitrophenyl)ethanone
CID 61079352
2-(3,4-dimethoxyphenyl)-1-(3,4-dimethylphenyl)ethanone
CID 43339993
2-(2-chloro-6-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone
CID 43379521
2-(3,4-dimethylphenyl)-1-(3-fluoro-4-methoxyphenyl)ethanone
CID 62551978
2-(3-fluorophenyl)-1-(4-methyl-3-nitrophenyl)ethanone
CID 61079539
2-(3-fluorophenyl)-1-(4-sulfanylphenyl)ethanone
CID 155354849
(3-fluorophenyl)-[4-(4-methoxy-3-methylbenzoyl)piperazin-1-yl]methanone
CID 110802324
N-[2-(3-fluorophenyl)ethyl]-3-methoxy-4-methylbenzamide
CID 9182358
2-bromo-1-(4-methoxy-3-methylphenyl)ethanone
CID 13440066

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone?
The IUPAC name of 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone (CID 43379558) is 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone.
What is the SMILES notation for 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone?
The canonical SMILES for 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone is COc1ccc(C(=O)Cc2cccc(F)c2)cc1C.
What is the InChIKey of 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone?
The InChIKey is ZNTRURVQVMRAEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FO2/c1-11-8-13(6-7-16(11)19-2)15(18)10-12-4-3-5-14(17)9-12/h3-9H,10H2,1-2H3.
What are the key properties of 2-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone?
2-(3-fluorophenyl)-1-(4-methoxy-3-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-(3-fluorophenyl)-1-(4-methoxy-3-methylphenyl)ethanone is sourced from PubChem (CID 43379558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).