2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide

C15H10Cl3N3O — CID 42737754

IUPAC2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
SMILESO=C(CCl)Nc1cccc(-c2cn3cc(Cl)cc(Cl)c3n2)c1
InChIInChI=1S/C15H10Cl3N3O/c16-6-14(22)19-11-3-1-2-9(4-11)13-8-21-7-10(17)5-12(18)15(21)20-13/h1-5,7-8H,6H2,(H,19,22)
InChIKeyAIYXPVPZAIGTHL-UHFFFAOYSA-N
MW354.62 g/mol
LogP4.49
Rot. Bonds3

About 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide

2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide (PubChem CID 42737754) has the molecular formula C15H10Cl3N3O and a molecular weight of 354.62 g/mol. Its IUPAC name is 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
PubChem CID42737754
Molecular FormulaC15H10Cl3N3O
Molecular Weight354.62 g/mol
Exact Mass352.99
IUPAC Name2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
SMILESO=C(CCl)Nc1cccc(-c2cn3cc(Cl)cc(Cl)c3n2)c1
InChIInChI=1S/C15H10Cl3N3O/c16-6-14(22)19-11-3-1-2-9(4-11)13-8-21-7-10(17)5-12(18)15(21)20-13/h1-5,7-8H,6H2,(H,19,22)
InChIKeyAIYXPVPZAIGTHL-UHFFFAOYSA-N
XLogP4.49
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.62
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide?
The IUPAC name of 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide (CID 42737754) is 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide.
What is the SMILES notation for 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide?
The canonical SMILES for 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide is O=C(CCl)Nc1cccc(-c2cn3cc(Cl)cc(Cl)c3n2)c1.
What is the InChIKey of 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide?
The InChIKey is AIYXPVPZAIGTHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10Cl3N3O/c16-6-14(22)19-11-3-1-2-9(4-11)13-8-21-7-10(17)5-12(18)15(21)20-13/h1-5,7-8H,6H2,(H,19,22).
What are the key properties of 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide?
2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide has a molecular weight of 354.62 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide is sourced from PubChem (CID 42737754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).