(2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone

C15H13FO4 — CID 15750347

IUPAC(2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccccc2F)c(O)c1OC
InChIInChI=1S/C15H13FO4/c1-19-12-8-7-10(14(18)15(12)20-2)13(17)9-5-3-4-6-11(9)16/h3-8,18H,1-2H3
InChIKeyMENPTHQIWNTWCZ-UHFFFAOYSA-N
MW276.26 g/mol
LogP2.78
Rot. Bonds4

About (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone

(2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone (PubChem CID 15750347) has the molecular formula C15H13FO4 and a molecular weight of 276.26 g/mol. Its IUPAC name is (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone.

Molecular Properties

Compound Name(2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone
PubChem CID15750347
Molecular FormulaC15H13FO4
Molecular Weight276.26 g/mol
Exact Mass276.08
IUPAC Name(2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone
SMILESCOc1ccc(C(=O)c2ccccc2F)c(O)c1OC
InChIInChI=1S/C15H13FO4/c1-19-12-8-7-10(14(18)15(12)20-2)13(17)9-5-3-4-6-11(9)16/h3-8,18H,1-2H3
InChIKeyMENPTHQIWNTWCZ-UHFFFAOYSA-N
XLogP2.78
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.26
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone 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

(2,4-dihydroxyphenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone
CID 66596654
2-(2-amino-3,4-dimethoxybenzoyl)benzonitrile
CID 69156462
bis(3-fluoro-2-methoxyphenyl)methanone
CID 174934550
[2-(2-fluorobenzoyl)phenyl]-(2-fluorophenyl)methanone
CID 130332183
N'-(2-fluorobenzoyl)-2,3-dimethoxybenzohydrazide
CID 921091
(3-chloro-4,5-dimethoxyphenyl)-(2-fluorophenyl)methanone
CID 62502800
(2-hydroxy-3-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 67681144
(2,3-dimethoxyphenyl)-(2-methoxyphenyl)methanone
CID 67592746
(3,4-dimethoxy-5-nitrophenyl)-(2-fluorophenyl)methanone;(2-fluorophenyl)-(4-hydroxy-3-methoxy-5-nitrophenyl)methanone
CID 158356325
(2-fluoro-4-methoxyphenyl)-(2-methoxyphenyl)methanone
CID 43561172
(Z)-1-(2-hydroxy-3,4-dimethoxyphenyl)-3-phenylprop-2-en-1-one
CID 92529821
(2-chloro-4-methylsulfonylphenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone
CID 57016786

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone?
The IUPAC name of (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone (CID 15750347) is (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone.
What is the SMILES notation for (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone?
The canonical SMILES for (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone is COc1ccc(C(=O)c2ccccc2F)c(O)c1OC.
What is the InChIKey of (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone?
The InChIKey is MENPTHQIWNTWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FO4/c1-19-12-8-7-10(14(18)15(12)20-2)13(17)9-5-3-4-6-11(9)16/h3-8,18H,1-2H3.
What are the key properties of (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone?
(2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone has a molecular weight of 276.26 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(2-hydroxy-3,4-dimethoxyphenyl)methanone is sourced from PubChem (CID 15750347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).