(3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone

C16H15FO3 — CID 106790442

IUPAC(3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccc(C)cc2OC)cc1F
InChIInChI=1S/C16H15FO3/c1-10-4-6-12(15(8-10)20-3)16(18)11-5-7-14(19-2)13(17)9-11/h4-9H,1-3H3
InChIKeyDEQVGHKUFLUVIJ-UHFFFAOYSA-N
MW274.29 g/mol
LogP3.38
Rot. Bonds4

About (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone

(3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone (PubChem CID 106790442) has the molecular formula C16H15FO3 and a molecular weight of 274.29 g/mol. Its IUPAC name is (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone.

Molecular Properties

Compound Name(3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone
PubChem CID106790442
Molecular FormulaC16H15FO3
Molecular Weight274.29 g/mol
Exact Mass274.10
IUPAC Name(3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccc(C)cc2OC)cc1F
InChIInChI=1S/C16H15FO3/c1-10-4-6-12(15(8-10)20-3)16(18)11-5-7-14(19-2)13(17)9-11/h4-9H,1-3H3
InChIKeyDEQVGHKUFLUVIJ-UHFFFAOYSA-N
XLogP3.38
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.29
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2,6-dimethyl-3-pyridinyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 115604695
(4-bromo-2-fluorophenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 43474023
(2,3-difluorophenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 57322240
(3-fluoro-4-methoxyphenyl)-(4-fluorophenyl)methanone
CID 3021160
(4-fluoro-2,6-dimethylphenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 106876723
(3-fluoro-4-methoxyphenyl)-(3-fluorophenyl)methanone
CID 22015795
(2-methoxy-4-methylphenyl)-(6-methyl-3-pyridinyl)methanone
CID 106790353
1-(3-fluoro-4-methoxyphenyl)-2-(2-methoxy-5-methylphenyl)ethanone
CID 115736498
3-fluoro-4-(2-methoxy-4-methylphenoxy)benzoic acid
CID 28604637
(4-chlorophenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 2757552
(4-bromo-2-chlorophenyl)-(3-fluoro-4-methoxyphenyl)methanone
CID 43805127
(3-fluoro-4-methoxyphenyl)-(4-methoxy-3,5-dimethylphenyl)methanone
CID 83044007

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone?
The IUPAC name of (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone (CID 106790442) is (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone.
What is the SMILES notation for (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone?
The canonical SMILES for (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone is COc1ccc(C(=O)c2ccc(C)cc2OC)cc1F.
What is the InChIKey of (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone?
The InChIKey is DEQVGHKUFLUVIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FO3/c1-10-4-6-12(15(8-10)20-3)16(18)11-5-7-14(19-2)13(17)9-11/h4-9H,1-3H3.
What are the key properties of (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone?
(3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone has a molecular weight of 274.29 g/mol, XLogP of 3.38, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methoxyphenyl)-(2-methoxy-4-methylphenyl)methanone is sourced from PubChem (CID 106790442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).