N,1-bis(4-fluorophenyl)benzimidazol-2-amine

C19H13F2N3 — CID 71472918

IUPACN,1-bis(4-fluorophenyl)benzimidazol-2-amine
SMILESFc1ccc(Nc2nc3ccccc3n2-c2ccc(F)cc2)cc1
InChIInChI=1S/C19H13F2N3/c20-13-5-9-15(10-6-13)22-19-23-17-3-1-2-4-18(17)24(19)16-11-7-14(21)8-12-16/h1-12H,(H,22,23)
InChIKeyQZVNAAZMGYVTSH-UHFFFAOYSA-N
MW321.33 g/mol
LogP5.05
Rot. Bonds3

About N,1-bis(4-fluorophenyl)benzimidazol-2-amine

N,1-bis(4-fluorophenyl)benzimidazol-2-amine (PubChem CID 71472918) has the molecular formula C19H13F2N3 and a molecular weight of 321.33 g/mol. Its IUPAC name is N,1-bis(4-fluorophenyl)benzimidazol-2-amine.

Molecular Properties

Compound NameN,1-bis(4-fluorophenyl)benzimidazol-2-amine
PubChem CID71472918
Molecular FormulaC19H13F2N3
Molecular Weight321.33 g/mol
Exact Mass321.11
IUPAC NameN,1-bis(4-fluorophenyl)benzimidazol-2-amine
SMILESFc1ccc(Nc2nc3ccccc3n2-c2ccc(F)cc2)cc1
InChIInChI=1S/C19H13F2N3/c20-13-5-9-15(10-6-13)22-19-23-17-3-1-2-4-18(17)24(19)16-11-7-14(21)8-12-16/h1-12H,(H,22,23)
InChIKeyQZVNAAZMGYVTSH-UHFFFAOYSA-N
XLogP5.05
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500321.33
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethyl-N-(4-fluorophenyl)benzimidazol-2-amine
CID 924376
1-(4-fluorophenyl)-2-(4-methylphenyl)benzimidazole
CID 95930125
6-chloro-N,1-diphenylbenzimidazol-2-amine
CID 46854683
4-(4-fluorophenyl)-3-oxoquinoxaline-2-carboxylic acid
CID 154631465
1-(4-fluorophenyl)-2-(4-methoxyphenyl)benzimidazole
CID 134816858
methyl 3-[(1-phenylbenzimidazol-2-yl)amino]benzoate
CID 141343666
1-(2-bromo-3-chlorophenyl)-N-phenylbenzimidazol-2-amine
CID 140915736
1-[[1-(4-fluorophenyl)benzimidazol-2-yl]methyl]pyridin-4-imine;hydrochloride
CID 10316147
N-(4-fluorophenyl)-4-methyl-1-phenylimidazol-2-amine
CID 106558735
2-bromo-1-phenylbenzimidazole
CID 84810012
N-(3-chloro-1-benzofuran-2-yl)-1-phenylbenzimidazol-2-amine
CID 155006081
3-[3-[4-[[1-(4-fluorophenyl)benzimidazol-2-yl]amino]piperidin-1-yl]propyl]-1H-benzimidazol-2-one
CID 12891760

Frequently Asked Questions

What is the IUPAC name of N,1-bis(4-fluorophenyl)benzimidazol-2-amine?
The IUPAC name of N,1-bis(4-fluorophenyl)benzimidazol-2-amine (CID 71472918) is N,1-bis(4-fluorophenyl)benzimidazol-2-amine.
What is the SMILES notation for N,1-bis(4-fluorophenyl)benzimidazol-2-amine?
The canonical SMILES for N,1-bis(4-fluorophenyl)benzimidazol-2-amine is Fc1ccc(Nc2nc3ccccc3n2-c2ccc(F)cc2)cc1.
What is the InChIKey of N,1-bis(4-fluorophenyl)benzimidazol-2-amine?
The InChIKey is QZVNAAZMGYVTSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F2N3/c20-13-5-9-15(10-6-13)22-19-23-17-3-1-2-4-18(17)24(19)16-11-7-14(21)8-12-16/h1-12H,(H,22,23).
What are the key properties of N,1-bis(4-fluorophenyl)benzimidazol-2-amine?
N,1-bis(4-fluorophenyl)benzimidazol-2-amine has a molecular weight of 321.33 g/mol, XLogP of 5.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-bis(4-fluorophenyl)benzimidazol-2-amine is sourced from PubChem (CID 71472918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).