2-(fluoromethyl)-2-methylbenzimidazole

C9H9FN2 — CID 173118032

IUPAC2-(fluoromethyl)-2-methylbenzimidazole
SMILESCC1(CF)N=c2ccccc2=N1
InChIInChI=1S/C9H9FN2/c1-9(6-10)11-7-4-2-3-5-8(7)12-9/h2-5H,6H2,1H3
InChIKeyQJBNSKDRZZVQSA-UHFFFAOYSA-N
MW164.18 g/mol
LogP0.63
Rot. Bonds1

About 2-(fluoromethyl)-2-methylbenzimidazole

2-(fluoromethyl)-2-methylbenzimidazole (PubChem CID 173118032) has the molecular formula C9H9FN2 and a molecular weight of 164.18 g/mol. Its IUPAC name is 2-(fluoromethyl)-2-methylbenzimidazole.

Molecular Properties

Compound Name2-(fluoromethyl)-2-methylbenzimidazole
PubChem CID173118032
Molecular FormulaC9H9FN2
Molecular Weight164.18 g/mol
Exact Mass164.07
IUPAC Name2-(fluoromethyl)-2-methylbenzimidazole
SMILESCC1(CF)N=c2ccccc2=N1
InChIInChI=1S/C9H9FN2/c1-9(6-10)11-7-4-2-3-5-8(7)12-9/h2-5H,6H2,1H3
InChIKeyQJBNSKDRZZVQSA-UHFFFAOYSA-N
XLogP0.63
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.18
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2H-Benzimidazol-2-ylidene)-2H-benzimidazole
CID 3339960
5-Fluoro-2,2-dimethyl-1,3-dioxidobenzimidazole-1,3-diium
CID 155548990
2H-benzimidazole
CID 9548684
2,2-Dimethyl-2H-benzimidazole
CID 11435022
5,6-Difluoro-2,2-dimethyl-2h-benzo[d]imidazole
CID 129851573
Difluoro-dimethyl-2h-benzoimidazole
CID 129851574
2-Methylenebenzimidazole
CID 22181905
4-Fluorospiro[benzimidazole-2,1'-cyclohexane]
CID 20389477
2-(2-Fluorobenzimidazol-2-yl)acetonitrile
CID 21683192
3a-Fluoro-2-methylindole
CID 68281758
N-tert-butyl-6-fluorocyclohexa-2,4-dien-1-imine
CID 69577422
N-tert-butyl-2-fluorocyclohexa-2,4-dien-1-imine
CID 69577423

Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-2-methylbenzimidazole?
The IUPAC name of 2-(fluoromethyl)-2-methylbenzimidazole (CID 173118032) is 2-(fluoromethyl)-2-methylbenzimidazole.
What is the SMILES notation for 2-(fluoromethyl)-2-methylbenzimidazole?
The canonical SMILES for 2-(fluoromethyl)-2-methylbenzimidazole is CC1(CF)N=c2ccccc2=N1.
What is the InChIKey of 2-(fluoromethyl)-2-methylbenzimidazole?
The InChIKey is QJBNSKDRZZVQSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN2/c1-9(6-10)11-7-4-2-3-5-8(7)12-9/h2-5H,6H2,1H3.
What are the key properties of 2-(fluoromethyl)-2-methylbenzimidazole?
2-(fluoromethyl)-2-methylbenzimidazole has a molecular weight of 164.18 g/mol, XLogP of 0.63, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-2-methylbenzimidazole is sourced from PubChem (CID 173118032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).