2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide

C15H10F3N3O2 — CID 75503771

IUPAC2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide
SMILESO=C(NCc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(F)c(F)c1F
InChIInChI=1S/C15H10F3N3O2/c16-9-3-2-8(12(17)13(9)18)14(22)19-6-7-1-4-10-11(5-7)21-15(23)20-10/h1-5H,6H2,(H,19,22)(H2,20,21,23)
InChIKeyMEGJTMFGJLTNTJ-UHFFFAOYSA-N
MW321.26 g/mol
LogP2.20
Rot. Bonds3

About 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide

2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide (PubChem CID 75503771) has the molecular formula C15H10F3N3O2 and a molecular weight of 321.26 g/mol. Its IUPAC name is 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide.

Molecular Properties

Compound Name2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide
PubChem CID75503771
Molecular FormulaC15H10F3N3O2
Molecular Weight321.26 g/mol
Exact Mass321.07
IUPAC Name2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide
SMILESO=C(NCc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(F)c(F)c1F
InChIInChI=1S/C15H10F3N3O2/c16-9-3-2-8(12(17)13(9)18)14(22)19-6-7-1-4-10-11(5-7)21-15(23)20-10/h1-5H,6H2,(H,19,22)(H2,20,21,23)
InChIKeyMEGJTMFGJLTNTJ-UHFFFAOYSA-N
XLogP2.20
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.26
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3H-benzimidazol-5-ylmethyl)-2,3,4-trifluorobenzamide
CID 110785475
4-chloro-3-fluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide
CID 75454611
N-[[4-(chloromethyl)phenyl]methyl]-2,3,4-trifluorobenzamide
CID 107233561
2,3,4-trifluoro-N-[[3-(hydroxymethyl)phenyl]methyl]benzamide
CID 79755129
1-benzyl-3-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]urea
CID 110775421
N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]-2-phenylacetamide
CID 110785246
3-[[(2,3,4-trifluorobenzoyl)amino]methyl]benzoic acid
CID 84761710
N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]pyridine-4-carboxamide;hydrochloride
CID 110785256
1-(4-chloro-3-fluorophenyl)-3-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]urea
CID 86807539
2,3,4-trifluoro-N-[(5-oxo-1,2-dihydropyrazol-3-yl)methyl]benzamide
CID 84582600
N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]quinoline-5-carboxamide
CID 75503534
2,3,4-trifluoro-N-[(4-sulfamoylphenyl)methyl]benzamide
CID 17248737

Frequently Asked Questions

What is the IUPAC name of 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide?
The IUPAC name of 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide (CID 75503771) is 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide.
What is the SMILES notation for 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide?
The canonical SMILES for 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide is O=C(NCc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(F)c(F)c1F.
What is the InChIKey of 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide?
The InChIKey is MEGJTMFGJLTNTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F3N3O2/c16-9-3-2-8(12(17)13(9)18)14(22)19-6-7-1-4-10-11(5-7)21-15(23)20-10/h1-5H,6H2,(H,19,22)(H2,20,21,23).
What are the key properties of 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide?
2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide has a molecular weight of 321.26 g/mol, XLogP of 2.20, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trifluoro-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]benzamide is sourced from PubChem (CID 75503771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).