4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide

C18H15Cl2N3O — CID 10291991

IUPAC4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide
SMILESCc1nc(-c2ccccc2Cl)n(NC(=O)c2ccc(Cl)cc2)c1C
InChIInChI=1S/C18H15Cl2N3O/c1-11-12(2)23(17(21-11)15-5-3-4-6-16(15)20)22-18(24)13-7-9-14(19)10-8-13/h3-10H,1-2H3,(H,22,24)
InChIKeyQZYCIXHCKFKSMQ-UHFFFAOYSA-N
MW360.24 g/mol
LogP4.86
Rot. Bonds3

About 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide

4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide (PubChem CID 10291991) has the molecular formula C18H15Cl2N3O and a molecular weight of 360.24 g/mol. Its IUPAC name is 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide
PubChem CID10291991
Molecular FormulaC18H15Cl2N3O
Molecular Weight360.24 g/mol
Exact Mass359.06
IUPAC Name4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide
SMILESCc1nc(-c2ccccc2Cl)n(NC(=O)c2ccc(Cl)cc2)c1C
InChIInChI=1S/C18H15Cl2N3O/c1-11-12(2)23(17(21-11)15-5-3-4-6-16(15)20)22-18(24)13-7-9-14(19)10-8-13/h3-10H,1-2H3,(H,22,24)
InChIKeyQZYCIXHCKFKSMQ-UHFFFAOYSA-N
XLogP4.86
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.24
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide?
The IUPAC name of 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide (CID 10291991) is 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide.
What is the SMILES notation for 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide?
The canonical SMILES for 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide is Cc1nc(-c2ccccc2Cl)n(NC(=O)c2ccc(Cl)cc2)c1C.
What is the InChIKey of 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide?
The InChIKey is QZYCIXHCKFKSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15Cl2N3O/c1-11-12(2)23(17(21-11)15-5-3-4-6-16(15)20)22-18(24)13-7-9-14(19)10-8-13/h3-10H,1-2H3,(H,22,24).
What are the key properties of 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide?
4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide has a molecular weight of 360.24 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-(2-chlorophenyl)-4,5-dimethylimidazol-1-yl]benzamide is sourced from PubChem (CID 10291991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).