4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide

C20H14FN3O — CID 100577627

IUPAC4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide
SMILESO=C(Nc1ccccc1F)c1ccc(-c2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C20H14FN3O/c21-15-5-1-2-6-16(15)24-20(25)14-11-9-13(10-12-14)19-22-17-7-3-4-8-18(17)23-19/h1-12H,(H,22,23)(H,24,25)
InChIKeyLUFHUTKWFJFTSW-UHFFFAOYSA-N
MW331.35 g/mol
LogP4.62
Rot. Bonds3

About 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide

4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide (PubChem CID 100577627) has the molecular formula C20H14FN3O and a molecular weight of 331.35 g/mol. Its IUPAC name is 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide.

Molecular Properties

Compound Name4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide
PubChem CID100577627
Molecular FormulaC20H14FN3O
Molecular Weight331.35 g/mol
Exact Mass331.11
IUPAC Name4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide
SMILESO=C(Nc1ccccc1F)c1ccc(-c2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C20H14FN3O/c21-15-5-1-2-6-16(15)24-20(25)14-11-9-13(10-12-14)19-22-17-7-3-4-8-18(17)23-19/h1-12H,(H,22,23)(H,24,25)
InChIKeyLUFHUTKWFJFTSW-UHFFFAOYSA-N
XLogP4.62
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.35
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(6-chloro-1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide
CID 100580067
N-[4-(1H-benzimidazol-2-yl)phenyl]-4-(2-oxo-2-phenylacetyl)benzamide
CID 2479214
4-(1H-benzimidazol-2-yl)-N-(2,6-dimethylphenyl)benzamide
CID 100577552
N-[4-(1H-benzimidazol-2-yl)phenyl]-4-bromobenzamide
CID 3011124
4-(1H-benzimidazol-2-yl)-N-(5-chloro-2-methoxyphenyl)benzamide
CID 100578035
2-(2,6-dichlorophenyl)-N-(2-fluorophenyl)-3H-benzimidazole-5-carboxamide
CID 66965567
N-[2-(1H-benzimidazol-2-yl)phenyl]-4-cyanobenzamide
CID 739930
4-(1H-benzimidazol-2-yl)-N-(2-phenylethyl)benzamide
CID 100577407
4-(1H-benzimidazol-2-yl)-N-butylbenzamide
CID 100577263
4-(1H-benzimidazol-2-yl)benzamide
CID 56736972
N-[4-(1H-benzimidazol-2-yl)phenyl]-4-nitrobenzamide
CID 3584641
N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]-3-fluorobenzamide
CID 17100747

Frequently Asked Questions

What is the IUPAC name of 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide?
The IUPAC name of 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide (CID 100577627) is 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide.
What is the SMILES notation for 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide?
The canonical SMILES for 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide is O=C(Nc1ccccc1F)c1ccc(-c2nc3ccccc3[nH]2)cc1.
What is the InChIKey of 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide?
The InChIKey is LUFHUTKWFJFTSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O/c21-15-5-1-2-6-16(15)24-20(25)14-11-9-13(10-12-14)19-22-17-7-3-4-8-18(17)23-19/h1-12H,(H,22,23)(H,24,25).
What are the key properties of 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide?
4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide has a molecular weight of 331.35 g/mol, XLogP of 4.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide is sourced from PubChem (CID 100577627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).