N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide

C10H7BrClN3O — CID 103481644

IUPACN-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Br)n1ccnc1
InChIInChI=1S/C10H7BrClN3O/c11-9-7(12)2-1-3-8(9)14-10(16)15-5-4-13-6-15/h1-6H,(H,14,16)
InChIKeyYJGMLOVVKDUYFZ-UHFFFAOYSA-N
MW300.54 g/mol
LogP3.38
Rot. Bonds1

About N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide

N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide (PubChem CID 103481644) has the molecular formula C10H7BrClN3O and a molecular weight of 300.54 g/mol. Its IUPAC name is N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide
PubChem CID103481644
Molecular FormulaC10H7BrClN3O
Molecular Weight300.54 g/mol
Exact Mass298.95
IUPAC NameN-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Br)n1ccnc1
InChIInChI=1S/C10H7BrClN3O/c11-9-7(12)2-1-3-8(9)14-10(16)15-5-4-13-6-15/h1-6H,(H,14,16)
InChIKeyYJGMLOVVKDUYFZ-UHFFFAOYSA-N
XLogP3.38
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.54
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-chloro-2-(dimethylamino)phenyl]imidazole-1-carboxamide
CID 81257815
N-(2,3-difluorophenyl)imidazole-1-carboxamide
CID 81269096
N-(2-imidazol-1-ylphenyl)imidazole-1-carboxamide
CID 81257478
N-[3-bromo-2-(methoxymethyl)phenyl]imidazole-1-carboxamide
CID 81268306
N-isoquinolin-5-ylimidazole-1-carboxamide
CID 81257687
N-[2-(methanesulfonamido)phenyl]imidazole-1-carboxamide
CID 81257028
N-(4-chloro-2-methylphenyl)imidazole-1-carboxamide
CID 79020132
N-[2-chloro-4-(trifluoromethyl)phenyl]imidazole-1-carboxamide
CID 81257554
N-(2-chloro-4-cyanophenyl)imidazole-1-carboxamide
CID 114003640
N-(2-cyano-3-methylphenyl)imidazole-1-carboxamide
CID 107801614
N-(2,4,6-trichlorophenyl)imidazole-1-carboxamide
CID 81257477
N-[2-(pyrrolidin-1-ylmethyl)phenyl]imidazole-1-carboxamide
CID 81257336

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide?
The IUPAC name of N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide (CID 103481644) is N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide.
What is the SMILES notation for N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide?
The canonical SMILES for N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide is O=C(Nc1cccc(Cl)c1Br)n1ccnc1.
What is the InChIKey of N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide?
The InChIKey is YJGMLOVVKDUYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrClN3O/c11-9-7(12)2-1-3-8(9)14-10(16)15-5-4-13-6-15/h1-6H,(H,14,16).
What are the key properties of N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide?
N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide has a molecular weight of 300.54 g/mol, XLogP of 3.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-3-chlorophenyl)imidazole-1-carboxamide is sourced from PubChem (CID 103481644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).