3,4-difluoro-N-(1H-imidazol-2-yl)benzamide

C10H7F2N3O — CID 63565198

IUPAC3,4-difluoro-N-(1H-imidazol-2-yl)benzamide
SMILESO=C(Nc1ncc[nH]1)c1ccc(F)c(F)c1
InChIInChI=1S/C10H7F2N3O/c11-7-2-1-6(5-8(7)12)9(16)15-10-13-3-4-14-10/h1-5H,(H2,13,14,15,16)
InChIKeyISCWVZFOTHPIRK-UHFFFAOYSA-N
MW223.18 g/mol
LogP1.94
Rot. Bonds2

About 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide

3,4-difluoro-N-(1H-imidazol-2-yl)benzamide (PubChem CID 63565198) has the molecular formula C10H7F2N3O and a molecular weight of 223.18 g/mol. Its IUPAC name is 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide.

Molecular Properties

Compound Name3,4-difluoro-N-(1H-imidazol-2-yl)benzamide
PubChem CID63565198
Molecular FormulaC10H7F2N3O
Molecular Weight223.18 g/mol
Exact Mass223.06
IUPAC Name3,4-difluoro-N-(1H-imidazol-2-yl)benzamide
SMILESO=C(Nc1ncc[nH]1)c1ccc(F)c(F)c1
InChIInChI=1S/C10H7F2N3O/c11-7-2-1-6(5-8(7)12)9(16)15-10-13-3-4-14-10/h1-5H,(H2,13,14,15,16)
InChIKeyISCWVZFOTHPIRK-UHFFFAOYSA-N
XLogP1.94
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.18
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-(1H-imidazol-2-yl)-3-methylbenzamide
CID 115694734
N-(1H-imidazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
CID 103998937
N-(1H-imidazol-2-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 60968095
(3,4-difluorophenyl)-(1H-imidazol-2-yl)methanone
CID 112731511
3,5-dibromo-N-(1H-imidazol-2-yl)benzamide
CID 103910174
4-(carbamoylamino)-N-(1H-imidazol-2-yl)benzamide
CID 55027633
N-(1H-imidazol-2-yl)-6-methylpyridine-3-carboxamide
CID 60968795
2,4-dichloro-N-(1H-imidazol-2-yl)benzamide
CID 55027572
N-(1H-imidazol-2-yl)-1-methyl-2-oxopyridine-4-carboxamide
CID 60966951
N-(1H-imidazol-2-yl)-3-methylsulfonylbenzamide
CID 60968772
2-fluoro-4-(3-hydroxyprop-1-ynyl)-N-(1H-imidazol-2-yl)benzamide
CID 63562624
N-(1H-imidazol-2-yl)-4-pyrazol-1-ylbenzamide
CID 60968230

Frequently Asked Questions

What is the IUPAC name of 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide?
The IUPAC name of 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide (CID 63565198) is 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide.
What is the SMILES notation for 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide?
The canonical SMILES for 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide is O=C(Nc1ncc[nH]1)c1ccc(F)c(F)c1.
What is the InChIKey of 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide?
The InChIKey is ISCWVZFOTHPIRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2N3O/c11-7-2-1-6(5-8(7)12)9(16)15-10-13-3-4-14-10/h1-5H,(H2,13,14,15,16).
What are the key properties of 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide?
3,4-difluoro-N-(1H-imidazol-2-yl)benzamide has a molecular weight of 223.18 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-difluoro-N-(1H-imidazol-2-yl)benzamide is sourced from PubChem (CID 63565198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).