2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole

C10H10F2N2O — CID 145162362

IUPAC2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole
SMILESCOc1ccc2c(c1)nc(C(F)F)n2C
InChIInChI=1S/C10H10F2N2O/c1-14-8-4-3-6(15-2)5-7(8)13-10(14)9(11)12/h3-5,9H,1-2H3
InChIKeyUYIHNCHKFCLFOJ-UHFFFAOYSA-N
MW212.20 g/mol
LogP2.52
Rot. Bonds2

About 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole

2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole (PubChem CID 145162362) has the molecular formula C10H10F2N2O and a molecular weight of 212.20 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole.

Molecular Properties

Compound Name2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole
PubChem CID145162362
Molecular FormulaC10H10F2N2O
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC Name2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole
SMILESCOc1ccc2c(c1)nc(C(F)F)n2C
InChIInChI=1S/C10H10F2N2O/c1-14-8-4-3-6(15-2)5-7(8)13-10(14)9(11)12/h3-5,9H,1-2H3
InChIKeyUYIHNCHKFCLFOJ-UHFFFAOYSA-N
XLogP2.52
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole?
The IUPAC name of 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole (CID 145162362) is 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole.
What is the SMILES notation for 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole?
The canonical SMILES for 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole is COc1ccc2c(c1)nc(C(F)F)n2C.
What is the InChIKey of 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole?
The InChIKey is UYIHNCHKFCLFOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2O/c1-14-8-4-3-6(15-2)5-7(8)13-10(14)9(11)12/h3-5,9H,1-2H3.
What are the key properties of 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole?
2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole has a molecular weight of 212.20 g/mol, XLogP of 2.52, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-methoxy-1-methylbenzimidazole is sourced from PubChem (CID 145162362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).