6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide

C20H13F2N3O2 — CID 122690335

IUPAC6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide
SMILESO=C(NO)c1cc2nc(-c3ccc(-c4ccccc4F)cc3)[nH]c2cc1F
InChIInChI=1S/C20H13F2N3O2/c21-15-4-2-1-3-13(15)11-5-7-12(8-6-11)19-23-17-9-14(20(26)25-27)16(22)10-18(17)24-19/h1-10,27H,(H,23,24)(H,25,26)
InChIKeyDZYLJHYJUZYAGN-UHFFFAOYSA-N
MW365.34 g/mol
LogP4.29
Rot. Bonds3

About 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide

6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide (PubChem CID 122690335) has the molecular formula C20H13F2N3O2 and a molecular weight of 365.34 g/mol. Its IUPAC name is 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide.

Molecular Properties

Compound Name6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide
PubChem CID122690335
Molecular FormulaC20H13F2N3O2
Molecular Weight365.34 g/mol
Exact Mass365.10
IUPAC Name6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide
SMILESO=C(NO)c1cc2nc(-c3ccc(-c4ccccc4F)cc3)[nH]c2cc1F
InChIInChI=1S/C20H13F2N3O2/c21-15-4-2-1-3-13(15)11-5-7-12(8-6-11)19-23-17-9-14(20(26)25-27)16(22)10-18(17)24-19/h1-10,27H,(H,23,24)(H,25,26)
InChIKeyDZYLJHYJUZYAGN-UHFFFAOYSA-N
XLogP4.29
TPSA78.01 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.34
LogP ≤ 54.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

6-bromo-2-[4-(2-fluorophenyl)phenyl]-1H-benzimidazole
CID 66841439
2-[4-(2-fluorophenyl)phenyl]-6-iodo-1H-benzimidazole
CID 66841194
2-[4-(2-fluorophenyl)phenyl]-N-hydroxyquinoline-4-carboxamide
CID 145464945
6-tert-butyl-2-[4-(2-fluorophenyl)phenyl]-1H-benzimidazole
CID 52940686
2-[4-(2-fluorophenyl)phenyl]-3H-benzimidazole-5-sulfonamide
CID 52941877
N-hydroxy-2-(2-phenylphenyl)-3H-benzimidazole-5-carboxamide
CID 122690172
2-(3-bromo-4-chlorophenyl)-6-fluoro-1H-benzimidazole-5-carboxylic acid
CID 107989457
5-bromo-6-fluoro-2-phenyl-1H-benzimidazole
CID 79631220
4-(5,6-difluoro-1H-benzimidazol-2-yl)phenol
CID 135927902
N-hydroxy-2-naphthalen-2-yl-3H-benzimidazole-5-carboxamide
CID 122690256
N-hydroxy-2-[4-[4-(trifluoromethyl)phenyl]phenyl]-3H-benzimidazole-5-carboxamide
CID 122690134
4-(6-chloro-1H-benzimidazol-2-yl)-N-(2-fluorophenyl)benzamide
CID 100580067

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide?
The IUPAC name of 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide (CID 122690335) is 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide.
What is the SMILES notation for 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide?
The canonical SMILES for 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide is O=C(NO)c1cc2nc(-c3ccc(-c4ccccc4F)cc3)[nH]c2cc1F.
What is the InChIKey of 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide?
The InChIKey is DZYLJHYJUZYAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F2N3O2/c21-15-4-2-1-3-13(15)11-5-7-12(8-6-11)19-23-17-9-14(20(26)25-27)16(22)10-18(17)24-19/h1-10,27H,(H,23,24)(H,25,26).
What are the key properties of 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide?
6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide has a molecular weight of 365.34 g/mol, XLogP of 4.29, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-[4-(2-fluorophenyl)phenyl]-N-hydroxy-1H-benzimidazole-5-carboxamide is sourced from PubChem (CID 122690335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).