2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide

C21H14Cl3N3O — CID 11373803

IUPAC2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide
SMILESO=C(Cc1c(-c2ccc(Cl)cc2)nc2c(Cl)cc(Cl)cn12)Nc1ccccc1
InChIInChI=1S/C21H14Cl3N3O/c22-14-8-6-13(7-9-14)20-18(11-19(28)25-16-4-2-1-3-5-16)27-12-15(23)10-17(24)21(27)26-20/h1-10,12H,11H2,(H,25,28)
InChIKeyWDMAUWGACDRLFF-UHFFFAOYSA-N
MW430.72 g/mol
LogP6.14
Rot. Bonds4

About 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide

2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide (PubChem CID 11373803) has the molecular formula C21H14Cl3N3O and a molecular weight of 430.72 g/mol. Its IUPAC name is 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide
PubChem CID11373803
Molecular FormulaC21H14Cl3N3O
Molecular Weight430.72 g/mol
Exact Mass429.02
IUPAC Name2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide
SMILESO=C(Cc1c(-c2ccc(Cl)cc2)nc2c(Cl)cc(Cl)cn12)Nc1ccccc1
InChIInChI=1S/C21H14Cl3N3O/c22-14-8-6-13(7-9-14)20-18(11-19(28)25-16-4-2-1-3-5-16)27-12-15(23)10-17(24)21(27)26-20/h1-10,12H,11H2,(H,25,28)
InChIKeyWDMAUWGACDRLFF-UHFFFAOYSA-N
XLogP6.14
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.72
LogP ≤ 56.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide?
The IUPAC name of 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide (CID 11373803) is 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide?
The canonical SMILES for 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide is O=C(Cc1c(-c2ccc(Cl)cc2)nc2c(Cl)cc(Cl)cn12)Nc1ccccc1.
What is the InChIKey of 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide?
The InChIKey is WDMAUWGACDRLFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H14Cl3N3O/c22-14-8-6-13(7-9-14)20-18(11-19(28)25-16-4-2-1-3-5-16)27-12-15(23)10-17(24)21(27)26-20/h1-10,12H,11H2,(H,25,28).
What are the key properties of 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide?
2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide has a molecular weight of 430.72 g/mol, XLogP of 6.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6,8-dichloro-2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]-N-phenylacetamide is sourced from PubChem (CID 11373803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).