2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide

C17H15Cl2N3O2 — CID 42693842

IUPAC2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide
SMILESCOc1ccccc1-c1nc2cc(C)ccn2c1NC(=O)C(Cl)Cl
InChIInChI=1S/C17H15Cl2N3O2/c1-10-7-8-22-13(9-10)20-14(16(22)21-17(23)15(18)19)11-5-3-4-6-12(11)24-2/h3-9,15H,1-2H3,(H,21,23)
InChIKeyAXZQIZUFFCAOSH-UHFFFAOYSA-N
MW364.23 g/mol
LogP4.06
Rot. Bonds4

About 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide

2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide (PubChem CID 42693842) has the molecular formula C17H15Cl2N3O2 and a molecular weight of 364.23 g/mol. Its IUPAC name is 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide.

Molecular Properties

Compound Name2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide
PubChem CID42693842
Molecular FormulaC17H15Cl2N3O2
Molecular Weight364.23 g/mol
Exact Mass363.05
IUPAC Name2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide
SMILESCOc1ccccc1-c1nc2cc(C)ccn2c1NC(=O)C(Cl)Cl
InChIInChI=1S/C17H15Cl2N3O2/c1-10-7-8-22-13(9-10)20-14(16(22)21-17(23)15(18)19)11-5-3-4-6-12(11)24-2/h3-9,15H,1-2H3,(H,21,23)
InChIKeyAXZQIZUFFCAOSH-UHFFFAOYSA-N
XLogP4.06
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.23
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide?
The IUPAC name of 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide (CID 42693842) is 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide.
What is the SMILES notation for 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide?
The canonical SMILES for 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide is COc1ccccc1-c1nc2cc(C)ccn2c1NC(=O)C(Cl)Cl.
What is the InChIKey of 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide?
The InChIKey is AXZQIZUFFCAOSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15Cl2N3O2/c1-10-7-8-22-13(9-10)20-14(16(22)21-17(23)15(18)19)11-5-3-4-6-12(11)24-2/h3-9,15H,1-2H3,(H,21,23).
What are the key properties of 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide?
2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide has a molecular weight of 364.23 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dichloro-N-[2-(2-methoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]acetamide is sourced from PubChem (CID 42693842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).