1-(2,5-difluorophenyl)-2,3-dimethoxybenzene

C14H12F2O2 — CID 165476912

IUPAC1-(2,5-difluorophenyl)-2,3-dimethoxybenzene
SMILESCOc1cccc(-c2cc(F)ccc2F)c1OC
InChIInChI=1S/C14H12F2O2/c1-17-13-5-3-4-10(14(13)18-2)11-8-9(15)6-7-12(11)16/h3-8H,1-2H3
InChIKeyAXSOWNPVYVJDJN-UHFFFAOYSA-N
MW250.24 g/mol
LogP3.65
Rot. Bonds3

About 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene

1-(2,5-difluorophenyl)-2,3-dimethoxybenzene (PubChem CID 165476912) has the molecular formula C14H12F2O2 and a molecular weight of 250.24 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-2,3-dimethoxybenzene
PubChem CID165476912
Molecular FormulaC14H12F2O2
Molecular Weight250.24 g/mol
Exact Mass250.08
IUPAC Name1-(2,5-difluorophenyl)-2,3-dimethoxybenzene
SMILESCOc1cccc(-c2cc(F)ccc2F)c1OC
InChIInChI=1S/C14H12F2O2/c1-17-13-5-3-4-10(14(13)18-2)11-8-9(15)6-7-12(11)16/h3-8H,1-2H3
InChIKeyAXSOWNPVYVJDJN-UHFFFAOYSA-N
XLogP3.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.24
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene 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-(2,5-difluorophenyl)-6-methoxyphenol
CID 83129806
1-[3-(2,3-dimethoxyphenyl)-4-fluorophenyl]-N-methylmethanamine
CID 82795419
5-(2,3-dimethoxyphenyl)-4-fluoro-2-methylaniline
CID 107593741
3-(2,5-difluorophenyl)-4,5-dimethoxybenzaldehyde
CID 82039124
5-chloro-2-(2,3-dimethoxyphenyl)aniline
CID 82794309
4-fluoro-3-(5-fluoro-2-methoxyphenyl)aniline
CID 104781195
1-fluoro-4-methoxy-2-(2-methoxyphenyl)benzene
CID 69262125
3-(2,3-dimethoxyphenyl)-6-(4-fluorophenyl)pyridazine
CID 77093795
2-[7-(2,3-dimethoxyphenyl)-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]ethanamine
CID 68963224
1,2,3-trimethoxybenzene;hydrofluoride
CID 174818666
4-(2,5-difluorophenyl)-3-methoxybenzoic acid
CID 53225988
1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
CID 46312197

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene?
The IUPAC name of 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene (CID 165476912) is 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene.
What is the SMILES notation for 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene?
The canonical SMILES for 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene is COc1cccc(-c2cc(F)ccc2F)c1OC.
What is the InChIKey of 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene?
The InChIKey is AXSOWNPVYVJDJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2O2/c1-17-13-5-3-4-10(14(13)18-2)11-8-9(15)6-7-12(11)16/h3-8H,1-2H3.
What are the key properties of 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene?
1-(2,5-difluorophenyl)-2,3-dimethoxybenzene has a molecular weight of 250.24 g/mol, XLogP of 3.65, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-2,3-dimethoxybenzene is sourced from PubChem (CID 165476912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).