N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide

C11H10ClN3O2 — CID 3468883

IUPACN-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide
SMILESCOc1cc(Cl)ccc1NC(=O)n1ccnc1
InChIInChI=1S/C11H10ClN3O2/c1-17-10-6-8(12)2-3-9(10)14-11(16)15-5-4-13-7-15/h2-7H,1H3,(H,14,16)
InChIKeyZXEGOUZSQOUJFI-UHFFFAOYSA-N
MW251.67 g/mol
LogP2.63
Rot. Bonds2

About N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide

N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide (PubChem CID 3468883) has the molecular formula C11H10ClN3O2 and a molecular weight of 251.67 g/mol. Its IUPAC name is N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide.

Molecular Properties

Compound NameN-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide
PubChem CID3468883
Molecular FormulaC11H10ClN3O2
Molecular Weight251.67 g/mol
Exact Mass251.05
IUPAC NameN-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide
SMILESCOc1cc(Cl)ccc1NC(=O)n1ccnc1
InChIInChI=1S/C11H10ClN3O2/c1-17-10-6-8(12)2-3-9(10)14-11(16)15-5-4-13-7-15/h2-7H,1H3,(H,14,16)
InChIKeyZXEGOUZSQOUJFI-UHFFFAOYSA-N
XLogP2.63
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.67
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxy-4-methylphenyl)imidazole-1-carboxamide
CID 81257037
N-(5-acetamido-2-methoxyphenyl)imidazole-1-carboxamide
CID 81258005
(5-chloro-2-methoxyphenyl)-imidazol-1-ylmethanone
CID 68987646
N-(3-fluoro-4-methoxyphenyl)imidazole-1-carboxamide
CID 81257589
N-(5-carbamoyl-2-methoxyphenyl)imidazole-1-carboxamide
CID 81257098
N-(5-chloro-2-cyanophenyl)imidazole-1-carboxamide
CID 81257010
N-(4-chloro-2-methoxyphenyl)acetamide
CID 593884
N-[3-(imidazole-1-carbonylamino)-4-methylphenyl]imidazole-1-carboxamide
CID 690741
N-(3,5-dichlorophenyl)imidazole-1-carboxamide
CID 81257838
N-[2-chloro-5-(propanoylamino)phenyl]imidazole-1-carboxamide
CID 81257482
N-[2-chloro-4-(trifluoromethyl)phenyl]imidazole-1-carboxamide
CID 81257554
N-(2,4,6-trichlorophenyl)imidazole-1-carboxamide
CID 81257477

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide?
The IUPAC name of N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide (CID 3468883) is N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide.
What is the SMILES notation for N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide?
The canonical SMILES for N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide is COc1cc(Cl)ccc1NC(=O)n1ccnc1.
What is the InChIKey of N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide?
The InChIKey is ZXEGOUZSQOUJFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10ClN3O2/c1-17-10-6-8(12)2-3-9(10)14-11(16)15-5-4-13-7-15/h2-7H,1H3,(H,14,16).
What are the key properties of N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide?
N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide has a molecular weight of 251.67 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methoxyphenyl)imidazole-1-carboxamide is sourced from PubChem (CID 3468883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).