4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole

C18H19FN2O — CID 18414681

IUPAC4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole
SMILESCc1cc(F)cc(C)c1COc1cccc2c1nc(C)n2C
InChIInChI=1S/C18H19FN2O/c1-11-8-14(19)9-12(2)15(11)10-22-17-7-5-6-16-18(17)20-13(3)21(16)4/h5-9H,10H2,1-4H3
InChIKeyMPODUBZIKYZWNL-UHFFFAOYSA-N
MW298.36 g/mol
LogP4.22
Rot. Bonds3

About 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole

4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole (PubChem CID 18414681) has the molecular formula C18H19FN2O and a molecular weight of 298.36 g/mol. Its IUPAC name is 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole.

Molecular Properties

Compound Name4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole
PubChem CID18414681
Molecular FormulaC18H19FN2O
Molecular Weight298.36 g/mol
Exact Mass298.15
IUPAC Name4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole
SMILESCc1cc(F)cc(C)c1COc1cccc2c1nc(C)n2C
InChIInChI=1S/C18H19FN2O/c1-11-8-14(19)9-12(2)15(11)10-22-17-7-5-6-16-18(17)20-13(3)21(16)4/h5-9H,10H2,1-4H3
InChIKeyMPODUBZIKYZWNL-UHFFFAOYSA-N
XLogP4.22
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole 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

Etodesnitazene
CID 149797386
ZK-806711
CID 448065
2-(2,6-Difluorophenyl)-1-[(2,6-difluorophenyl)methyl]-4-methoxy-benzimidazole
CID 492672
[2-(1H-Benzoimidazol-4-yloxy)-ethyl]-benzyl-amine
CID 9881815
Benzyl-[2-(2-trifluoromethyl-1H-benzoimidazol-4-yloxy)-ethyl]-amine
CID 9840672
7-{6-[1-(1-Imino-ethyl)-piperidin-4-yloxy]-2-isopropyl-benzoimidazol-1-ylmethyl}-naphthalene-2-carboxamidine
CID 10345176
1-Benzyl-7-methoxy-2-piperazin-1-ylbenzimidazole
CID 11723654
8-Fluoro-6-methoxy-3,4-dimethyl-1-(2-methylphenyl)imidazo[1,5-a]quinoxaline
CID 42630193
[1-[(2-Methoxyphenyl)methyl]benzimidazol-2-yl]methanol
CID 755585
1-[2-(4-fluorophenoxy)ethyl]-2-methyl-1H-benzimidazole
CID 761921
2-Methyl-1-[2-(4-methylphenoxy)ethyl]benzimidazole
CID 790960
2-(phenoxymethyl)-1-propyl-1H-benzimidazole
CID 921242

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole?
The IUPAC name of 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole (CID 18414681) is 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole.
What is the SMILES notation for 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole?
The canonical SMILES for 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole is Cc1cc(F)cc(C)c1COc1cccc2c1nc(C)n2C.
What is the InChIKey of 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole?
The InChIKey is MPODUBZIKYZWNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O/c1-11-8-14(19)9-12(2)15(11)10-22-17-7-5-6-16-18(17)20-13(3)21(16)4/h5-9H,10H2,1-4H3.
What are the key properties of 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole?
4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole has a molecular weight of 298.36 g/mol, XLogP of 4.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluoro-2,6-dimethylphenyl)methoxy]-1,2-dimethylbenzimidazole is sourced from PubChem (CID 18414681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).