1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene

C15H14F2O — CID 143974540

IUPAC1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene
SMILESCOc1ccc(C)cc1-c1cc(C)cc(F)c1F
InChIInChI=1S/C15H14F2O/c1-9-4-5-14(18-3)11(6-9)12-7-10(2)8-13(16)15(12)17/h4-8H,1-3H3
InChIKeyKKVPJDJRWGEKTL-UHFFFAOYSA-N
MW248.27 g/mol
LogP4.26
Rot. Bonds2

About 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene

1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene (PubChem CID 143974540) has the molecular formula C15H14F2O and a molecular weight of 248.27 g/mol. Its IUPAC name is 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene.

Molecular Properties

Compound Name1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene
PubChem CID143974540
Molecular FormulaC15H14F2O
Molecular Weight248.27 g/mol
Exact Mass248.10
IUPAC Name1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene
SMILESCOc1ccc(C)cc1-c1cc(C)cc(F)c1F
InChIInChI=1S/C15H14F2O/c1-9-4-5-14(18-3)11(6-9)12-7-10(2)8-13(16)15(12)17/h4-8H,1-3H3
InChIKeyKKVPJDJRWGEKTL-UHFFFAOYSA-N
XLogP4.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.27
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene 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-difluoro-3-(2-methoxy-5-methylphenyl)benzene
CID 119008947
ethane;1,2,3,4,5-pentafluoro-6-(2-methoxy-5-methylphenyl)benzene
CID 144565369
1-[4-fluoro-3-(2-methoxy-5-methylphenyl)phenyl]-N-methylethanamine
CID 82540228
2-fluoro-1-(2-methoxyphenyl)-4-methylbenzene
CID 155698567
1-methoxy-2-[2-methoxy-3-(2-methoxy-5-methylphenyl)phenyl]-4-methylbenzene
CID 13360661
2-fluoro-1,3-bis(2-fluoro-5-methylphenyl)-5-methylbenzene
CID 13230580
2,6-bis(2-methoxy-5-methylphenyl)phenol
CID 71343652
2-(2,5-dimethoxyphenyl)-1,4-dimethylbenzene
CID 9003880
5-(2-fluoro-5-methylphenyl)-2-methoxyphenol
CID 53220775
1-[4-methoxy-3-(2-methoxy-5-methylphenyl)phenyl]ethanamine
CID 82541809
3-(2,5-dimethylphenyl)-4-methoxyaniline
CID 39247090
5-(2-methoxy-5-methylphenyl)-1H-imidazol-4-amine
CID 82469801

Frequently Asked Questions

What is the IUPAC name of 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene?
The IUPAC name of 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene (CID 143974540) is 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene.
What is the SMILES notation for 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene?
The canonical SMILES for 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene is COc1ccc(C)cc1-c1cc(C)cc(F)c1F.
What is the InChIKey of 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene?
The InChIKey is KKVPJDJRWGEKTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O/c1-9-4-5-14(18-3)11(6-9)12-7-10(2)8-13(16)15(12)17/h4-8H,1-3H3.
What are the key properties of 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene?
1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene has a molecular weight of 248.27 g/mol, XLogP of 4.26, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-difluoro-3-(2-methoxy-5-methylphenyl)-5-methylbenzene is sourced from PubChem (CID 143974540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).