2-bromo-1-cyclopropyl-6-fluorobenzimidazole

C10H8BrFN2 — CID 83844057

IUPAC2-bromo-1-cyclopropyl-6-fluorobenzimidazole
SMILESFc1ccc2nc(Br)n(C3CC3)c2c1
InChIInChI=1S/C10H8BrFN2/c11-10-13-8-4-1-6(12)5-9(8)14(10)7-2-3-7/h1,4-5,7H,2-3H2
InChIKeyRWJDEWNPMJGURU-UHFFFAOYSA-N
MW255.09 g/mol
LogP3.27
Rot. Bonds1

About 2-bromo-1-cyclopropyl-6-fluorobenzimidazole

2-bromo-1-cyclopropyl-6-fluorobenzimidazole (PubChem CID 83844057) has the molecular formula C10H8BrFN2 and a molecular weight of 255.09 g/mol. Its IUPAC name is 2-bromo-1-cyclopropyl-6-fluorobenzimidazole.

Molecular Properties

Compound Name2-bromo-1-cyclopropyl-6-fluorobenzimidazole
PubChem CID83844057
Molecular FormulaC10H8BrFN2
Molecular Weight255.09 g/mol
Exact Mass253.99
IUPAC Name2-bromo-1-cyclopropyl-6-fluorobenzimidazole
SMILESFc1ccc2nc(Br)n(C3CC3)c2c1
InChIInChI=1S/C10H8BrFN2/c11-10-13-8-4-1-6(12)5-9(8)14(10)7-2-3-7/h1,4-5,7H,2-3H2
InChIKeyRWJDEWNPMJGURU-UHFFFAOYSA-N
XLogP3.27
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.09
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-1-cyclopropyl-6-fluorobenzimidazole?
The IUPAC name of 2-bromo-1-cyclopropyl-6-fluorobenzimidazole (CID 83844057) is 2-bromo-1-cyclopropyl-6-fluorobenzimidazole.
What is the SMILES notation for 2-bromo-1-cyclopropyl-6-fluorobenzimidazole?
The canonical SMILES for 2-bromo-1-cyclopropyl-6-fluorobenzimidazole is Fc1ccc2nc(Br)n(C3CC3)c2c1.
What is the InChIKey of 2-bromo-1-cyclopropyl-6-fluorobenzimidazole?
The InChIKey is RWJDEWNPMJGURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrFN2/c11-10-13-8-4-1-6(12)5-9(8)14(10)7-2-3-7/h1,4-5,7H,2-3H2.
What are the key properties of 2-bromo-1-cyclopropyl-6-fluorobenzimidazole?
2-bromo-1-cyclopropyl-6-fluorobenzimidazole has a molecular weight of 255.09 g/mol, XLogP of 3.27, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-1-cyclopropyl-6-fluorobenzimidazole is sourced from PubChem (CID 83844057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).