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

C10H7BrClN3O2 — CID 81271762

IUPACN-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Br)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C10H7BrClN3O2/c11-6-3-5(12)1-2-7(6)14-9(16)8-4-13-10(17)15-8/h1-4H,(H,14,16)(H2,13,15,17)
InChIKeyYNRGOGBCMNHEKG-UHFFFAOYSA-N
MW316.54 g/mol
LogP2.37
Rot. Bonds2

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

N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide (PubChem CID 81271762) has the molecular formula C10H7BrClN3O2 and a molecular weight of 316.54 g/mol. Its IUPAC name is N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
PubChem CID81271762
Molecular FormulaC10H7BrClN3O2
Molecular Weight316.54 g/mol
Exact Mass314.94
IUPAC NameN-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1Br)c1c[nH]c(=O)[nH]1
InChIInChI=1S/C10H7BrClN3O2/c11-6-3-5(12)1-2-7(6)14-9(16)8-4-13-10(17)15-8/h1-4H,(H,14,16)(H2,13,15,17)
InChIKeyYNRGOGBCMNHEKG-UHFFFAOYSA-N
XLogP2.37
TPSA77.75 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.54
LogP ≤ 52.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-4-sulfamoylphenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 61128605
N-[4-chloro-2-(3-hydroxyprop-1-ynyl)phenyl]-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 81262739
N-(2-bromo-5-methoxyphenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 63091406
N-(2,4-dichlorophenyl)-2,4-dioxo-1H-pyrimidine-5-carboxamide
CID 110864096
N-(2-bromo-4-chlorophenyl)-4-chloro-2-fluorobenzamide
CID 81027870
(2-bromo-4-chlorophenyl)urea
CID 81003362
4-bromo-N-(2,4-dichlorophenyl)-1H-pyrrole-2-carboxamide
CID 36679405
2-chloro-6-[(2-oxo-1,3-dihydroimidazole-4-carbonyl)amino]benzoic acid
CID 63724627
N-(2-bromo-4-chlorophenyl)-2,3,4-trifluorobenzamide
CID 81024059
2-amino-N-(2-bromo-4-chlorophenyl)benzamide
CID 81262559
N-(2-bromo-4-chlorophenyl)-1H-indole-6-carboxamide
CID 81024878
4-bromo-N-(2,5-dichlorophenyl)-1H-pyrrole-2-carboxamide
CID 43410564

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The IUPAC name of N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide (CID 81271762) is N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide.
What is the SMILES notation for N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The canonical SMILES for N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide is O=C(Nc1ccc(Cl)cc1Br)c1c[nH]c(=O)[nH]1.
What is the InChIKey of N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide?
The InChIKey is YNRGOGBCMNHEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrClN3O2/c11-6-3-5(12)1-2-7(6)14-9(16)8-4-13-10(17)15-8/h1-4H,(H,14,16)(H2,13,15,17).
What are the key properties of N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide?
N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide has a molecular weight of 316.54 g/mol, XLogP of 2.37, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-4-chlorophenyl)-2-oxo-1,3-dihydroimidazole-4-carboxamide is sourced from PubChem (CID 81271762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).