2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine

C16H16ClN3O2 — CID 135335373

IUPAC2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine
SMILESCNc1ccn2cc(-c3cc(Cl)c(OC)cc3OC)nc2c1
InChIInChI=1S/C16H16ClN3O2/c1-18-10-4-5-20-9-13(19-16(20)6-10)11-7-12(17)15(22-3)8-14(11)21-2/h4-9,18H,1-3H3
InChIKeyATWHEVKPFPHNIT-UHFFFAOYSA-N
MW317.78 g/mol
LogP3.71
Rot. Bonds4

About 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine

2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine (PubChem CID 135335373) has the molecular formula C16H16ClN3O2 and a molecular weight of 317.78 g/mol. Its IUPAC name is 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine.

Molecular Properties

Compound Name2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine
PubChem CID135335373
Molecular FormulaC16H16ClN3O2
Molecular Weight317.78 g/mol
Exact Mass317.09
IUPAC Name2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine
SMILESCNc1ccn2cc(-c3cc(Cl)c(OC)cc3OC)nc2c1
InChIInChI=1S/C16H16ClN3O2/c1-18-10-4-5-20-9-13(19-16(20)6-10)11-7-12(17)15(22-3)8-14(11)21-2/h4-9,18H,1-3H3
InChIKeyATWHEVKPFPHNIT-UHFFFAOYSA-N
XLogP3.71
TPSA47.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.78
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine?
The IUPAC name of 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine (CID 135335373) is 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine.
What is the SMILES notation for 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine?
The canonical SMILES for 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine is CNc1ccn2cc(-c3cc(Cl)c(OC)cc3OC)nc2c1.
What is the InChIKey of 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine?
The InChIKey is ATWHEVKPFPHNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClN3O2/c1-18-10-4-5-20-9-13(19-16(20)6-10)11-7-12(17)15(22-3)8-14(11)21-2/h4-9,18H,1-3H3.
What are the key properties of 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine?
2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine has a molecular weight of 317.78 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2,4-dimethoxyphenyl)-N-methylimidazo[1,2-a]pyridin-7-amine is sourced from PubChem (CID 135335373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).