1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine

C14H10F3N3 — CID 103592718

IUPAC1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
SMILESCc1cc2c(cc1F)nc(N)n2-c1cc(F)ccc1F
InChIInChI=1S/C14H10F3N3/c1-7-4-13-11(6-10(7)17)19-14(18)20(13)12-5-8(15)2-3-9(12)16/h2-6H,1H3,(H2,18,19)
InChIKeyNCXWRRXTCWEZSG-UHFFFAOYSA-N
MW277.25 g/mol
LogP3.33
Rot. Bonds1

About 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine

1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine (PubChem CID 103592718) has the molecular formula C14H10F3N3 and a molecular weight of 277.25 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
PubChem CID103592718
Molecular FormulaC14H10F3N3
Molecular Weight277.25 g/mol
Exact Mass277.08
IUPAC Name1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
SMILESCc1cc2c(cc1F)nc(N)n2-c1cc(F)ccc1F
InChIInChI=1S/C14H10F3N3/c1-7-4-13-11(6-10(7)17)19-14(18)20(13)12-5-8(15)2-3-9(12)16/h2-6H,1H3,(H2,18,19)
InChIKeyNCXWRRXTCWEZSG-UHFFFAOYSA-N
XLogP3.33
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.25
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine 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-chloro-4-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592726
1-(2,4-dichlorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592709
1-(2,5-dimethylphenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592661
5-bromo-1-(2,5-difluorophenyl)-6-fluorobenzimidazol-2-amine
CID 66087851
5-fluoro-1-(3-fluorophenyl)-6-methylbenzimidazol-2-amine
CID 103592659
1-(3,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592691
1-(2,5-difluorophenyl)-7-methylbenzimidazol-2-amine
CID 115552264
1-(3,5-dimethylphenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103592692
1-(2,5-difluoro-4-methylphenyl)-5-iodobenzimidazol-2-amine
CID 103586598
1-(2-fluoro-5-methylphenyl)-5-iodobenzimidazol-2-amine
CID 66081783
1-(2-chloro-6-fluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine
CID 103593159
4-(2-amino-5-fluoro-6-methylbenzimidazol-1-yl)-3-chlorobenzonitrile
CID 107809092

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine?
The IUPAC name of 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine (CID 103592718) is 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine.
What is the SMILES notation for 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine?
The canonical SMILES for 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine is Cc1cc2c(cc1F)nc(N)n2-c1cc(F)ccc1F.
What is the InChIKey of 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine?
The InChIKey is NCXWRRXTCWEZSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F3N3/c1-7-4-13-11(6-10(7)17)19-14(18)20(13)12-5-8(15)2-3-9(12)16/h2-6H,1H3,(H2,18,19).
What are the key properties of 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine?
1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine has a molecular weight of 277.25 g/mol, XLogP of 3.33, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-5-fluoro-6-methylbenzimidazol-2-amine is sourced from PubChem (CID 103592718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).