N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide

C14H10ClN3O2 — CID 110701251

IUPACN-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cccc2[nH]c(=O)[nH]c12
InChIInChI=1S/C14H10ClN3O2/c15-8-4-6-9(7-5-8)16-13(19)10-2-1-3-11-12(10)18-14(20)17-11/h1-7H,(H,16,19)(H2,17,18,20)
InChIKeyJAFAMZSIKFOBTE-UHFFFAOYSA-N
MW287.71 g/mol
LogP2.76
Rot. Bonds2

About N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide

N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide (PubChem CID 110701251) has the molecular formula C14H10ClN3O2 and a molecular weight of 287.71 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
PubChem CID110701251
Molecular FormulaC14H10ClN3O2
Molecular Weight287.71 g/mol
Exact Mass287.05
IUPAC NameN-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1cccc2[nH]c(=O)[nH]c12
InChIInChI=1S/C14H10ClN3O2/c15-8-4-6-9(7-5-8)16-13(19)10-2-1-3-11-12(10)18-14(20)17-11/h1-7H,(H,16,19)(H2,17,18,20)
InChIKeyJAFAMZSIKFOBTE-UHFFFAOYSA-N
XLogP2.76
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.71
LogP ≤ 52.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-oxo-N-phenyl-1,3-dihydrobenzimidazole-4-carboxamide
CID 110701230
N-(3,4-difluorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
CID 110701322
N-cyclopentadecyl-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
CID 72548098
2-chloro-N-(4-chlorophenyl)benzamide;4-chloro-N-(4-chlorophenyl)benzamide
CID 159735192
N-(2-morpholin-4-ylphenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
CID 110701288
N-[3-(dimethylamino)propyl]-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide
CID 110701163
2-(4-chlorophenyl)-N-phenylbenzamide
CID 102340259
CID 71439818
CID 71439818
2-(aminomethyl)-N-(4-chlorophenyl)benzamide
CID 82546810
N-(4-chlorophenyl)-2-(methylamino)pyridine-3-carboxamide
CID 62167597
methyl 2-amino-3-[(4-chlorophenyl)carbamoyl]benzoate
CID 69478568
N-(4-chlorophenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]amino]benzamide
CID 18205586

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide (CID 110701251) is N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide is O=C(Nc1ccc(Cl)cc1)c1cccc2[nH]c(=O)[nH]c12.
What is the InChIKey of N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
The InChIKey is JAFAMZSIKFOBTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O2/c15-8-4-6-9(7-5-8)16-13(19)10-2-1-3-11-12(10)18-14(20)17-11/h1-7H,(H,16,19)(H2,17,18,20).
What are the key properties of N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide?
N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide has a molecular weight of 287.71 g/mol, XLogP of 2.76, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-oxo-1,3-dihydrobenzimidazole-4-carboxamide is sourced from PubChem (CID 110701251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).