2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide

C21H16ClN3O — CID 23792325

IUPAC2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
SMILESCc1cccc2nc(-c3ccccc3)c(NC(=O)c3ccccc3Cl)n12
InChIInChI=1S/C21H16ClN3O/c1-14-8-7-13-18-23-19(15-9-3-2-4-10-15)20(25(14)18)24-21(26)16-11-5-6-12-17(16)22/h2-13H,1H3,(H,24,26)
InChIKeyPHZXXRCTLZPDRZ-UHFFFAOYSA-N
MW361.83 g/mol
LogP5.22
Rot. Bonds3

About 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide

2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide (PubChem CID 23792325) has the molecular formula C21H16ClN3O and a molecular weight of 361.83 g/mol. Its IUPAC name is 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide.

Molecular Properties

Compound Name2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
PubChem CID23792325
Molecular FormulaC21H16ClN3O
Molecular Weight361.83 g/mol
Exact Mass361.10
IUPAC Name2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide
SMILESCc1cccc2nc(-c3ccccc3)c(NC(=O)c3ccccc3Cl)n12
InChIInChI=1S/C21H16ClN3O/c1-14-8-7-13-18-23-19(15-9-3-2-4-10-15)20(25(14)18)24-21(26)16-11-5-6-12-17(16)22/h2-13H,1H3,(H,24,26)
InChIKeyPHZXXRCTLZPDRZ-UHFFFAOYSA-N
XLogP5.22
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.83
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The IUPAC name of 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide (CID 23792325) is 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide.
What is the SMILES notation for 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The canonical SMILES for 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide is Cc1cccc2nc(-c3ccccc3)c(NC(=O)c3ccccc3Cl)n12.
What is the InChIKey of 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
The InChIKey is PHZXXRCTLZPDRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16ClN3O/c1-14-8-7-13-18-23-19(15-9-3-2-4-10-15)20(25(14)18)24-21(26)16-11-5-6-12-17(16)22/h2-13H,1H3,(H,24,26).
What are the key properties of 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide?
2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide has a molecular weight of 361.83 g/mol, XLogP of 5.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(5-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzamide is sourced from PubChem (CID 23792325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).