N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine

C20H17ClN4O — CID 122578342

IUPACN-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
SMILESCOc1ccc(Nc2cccc(-c3c(C)nc4ccccn34)n2)cc1Cl
InChIInChI=1S/C20H17ClN4O/c1-13-20(25-11-4-3-8-19(25)22-13)16-6-5-7-18(24-16)23-14-9-10-17(26-2)15(21)12-14/h3-12H,1-2H3,(H,23,24)
InChIKeyIJCYZOGQSIULBO-UHFFFAOYSA-N
MW364.84 g/mol
LogP5.11
Rot. Bonds4

About N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine

N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine (PubChem CID 122578342) has the molecular formula C20H17ClN4O and a molecular weight of 364.84 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
PubChem CID122578342
Molecular FormulaC20H17ClN4O
Molecular Weight364.84 g/mol
Exact Mass364.11
IUPAC NameN-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
SMILESCOc1ccc(Nc2cccc(-c3c(C)nc4ccccn34)n2)cc1Cl
InChIInChI=1S/C20H17ClN4O/c1-13-20(25-11-4-3-8-19(25)22-13)16-6-5-7-18(24-16)23-14-9-10-17(26-2)15(21)12-14/h3-12H,1-2H3,(H,23,24)
InChIKeyIJCYZOGQSIULBO-UHFFFAOYSA-N
XLogP5.11
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.84
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine (CID 122578342) is N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine is COc1ccc(Nc2cccc(-c3c(C)nc4ccccn34)n2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine?
The InChIKey is IJCYZOGQSIULBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17ClN4O/c1-13-20(25-11-4-3-8-19(25)22-13)16-6-5-7-18(24-16)23-14-9-10-17(26-2)15(21)12-14/h3-12H,1-2H3,(H,23,24).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine?
N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine has a molecular weight of 364.84 g/mol, XLogP of 5.11, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-6-(2-methylimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine is sourced from PubChem (CID 122578342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).