1-(2-fluorophenyl)benzimidazol-2-amine

C13H10FN3 — CID 43148844

IUPAC1-(2-fluorophenyl)benzimidazol-2-amine
SMILESNc1nc2ccccc2n1-c1ccccc1F
InChIInChI=1S/C13H10FN3/c14-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)16-13(17)15/h1-8H,(H2,15,16)
InChIKeyPDQPGKBWLNFWPE-UHFFFAOYSA-N
MW227.24 g/mol
LogP2.75
Rot. Bonds1

About 1-(2-fluorophenyl)benzimidazol-2-amine

1-(2-fluorophenyl)benzimidazol-2-amine (PubChem CID 43148844) has the molecular formula C13H10FN3 and a molecular weight of 227.24 g/mol. Its IUPAC name is 1-(2-fluorophenyl)benzimidazol-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)benzimidazol-2-amine
PubChem CID43148844
Molecular FormulaC13H10FN3
Molecular Weight227.24 g/mol
Exact Mass227.09
IUPAC Name1-(2-fluorophenyl)benzimidazol-2-amine
SMILESNc1nc2ccccc2n1-c1ccccc1F
InChIInChI=1S/C13H10FN3/c14-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)16-13(17)15/h1-8H,(H2,15,16)
InChIKeyPDQPGKBWLNFWPE-UHFFFAOYSA-N
XLogP2.75
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.24
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)benzimidazol-2-amine?
The IUPAC name of 1-(2-fluorophenyl)benzimidazol-2-amine (CID 43148844) is 1-(2-fluorophenyl)benzimidazol-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)benzimidazol-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)benzimidazol-2-amine is Nc1nc2ccccc2n1-c1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)benzimidazol-2-amine?
The InChIKey is PDQPGKBWLNFWPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3/c14-9-5-1-3-7-11(9)17-12-8-4-2-6-10(12)16-13(17)15/h1-8H,(H2,15,16).
What are the key properties of 1-(2-fluorophenyl)benzimidazol-2-amine?
1-(2-fluorophenyl)benzimidazol-2-amine has a molecular weight of 227.24 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)benzimidazol-2-amine is sourced from PubChem (CID 43148844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).