2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

C21H15Cl2N3O — CID 121149101

IUPAC2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCc1cccn2cc(-c3ccccc3NC(=O)c3cc(Cl)ccc3Cl)nc12
InChIInChI=1S/C21H15Cl2N3O/c1-13-5-4-10-26-12-19(24-20(13)26)15-6-2-3-7-18(15)25-21(27)16-11-14(22)8-9-17(16)23/h2-12H,1H3,(H,25,27)
InChIKeySITPEEPAIFUUHV-UHFFFAOYSA-N
MW396.28 g/mol
LogP5.87
Rot. Bonds3

About 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (PubChem CID 121149101) has the molecular formula C21H15Cl2N3O and a molecular weight of 396.28 g/mol. Its IUPAC name is 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
PubChem CID121149101
Molecular FormulaC21H15Cl2N3O
Molecular Weight396.28 g/mol
Exact Mass395.06
IUPAC Name2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCc1cccn2cc(-c3ccccc3NC(=O)c3cc(Cl)ccc3Cl)nc12
InChIInChI=1S/C21H15Cl2N3O/c1-13-5-4-10-26-12-19(24-20(13)26)15-6-2-3-7-18(15)25-21(27)16-11-14(22)8-9-17(16)23/h2-12H,1H3,(H,25,27)
InChIKeySITPEEPAIFUUHV-UHFFFAOYSA-N
XLogP5.87
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500396.28
LogP ≤ 55.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The IUPAC name of 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (CID 121149101) is 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.
What is the SMILES notation for 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The canonical SMILES for 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is Cc1cccn2cc(-c3ccccc3NC(=O)c3cc(Cl)ccc3Cl)nc12.
What is the InChIKey of 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The InChIKey is SITPEEPAIFUUHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15Cl2N3O/c1-13-5-4-10-26-12-19(24-20(13)26)15-6-2-3-7-18(15)25-21(27)16-11-14(22)8-9-17(16)23/h2-12H,1H3,(H,25,27).
What are the key properties of 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide has a molecular weight of 396.28 g/mol, XLogP of 5.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-[2-(8-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is sourced from PubChem (CID 121149101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).