[2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine

C17H19N3O — CID 39199338

IUPAC[2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCCOc1ccc(-c2nc3ccc(C)cn3c2CN)cc1
InChIInChI=1S/C17H19N3O/c1-3-21-14-7-5-13(6-8-14)17-15(10-18)20-11-12(2)4-9-16(20)19-17/h4-9,11H,3,10,18H2,1-2H3
InChIKeyXQNAJNAPXKJXAY-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.17
Rot. Bonds4

About [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine

[2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine (PubChem CID 39199338) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine
PubChem CID39199338
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC Name[2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCCOc1ccc(-c2nc3ccc(C)cn3c2CN)cc1
InChIInChI=1S/C17H19N3O/c1-3-21-14-7-5-13(6-8-14)17-15(10-18)20-11-12(2)4-9-16(20)19-17/h4-9,11H,3,10,18H2,1-2H3
InChIKeyXQNAJNAPXKJXAY-UHFFFAOYSA-N
XLogP3.17
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine?
The IUPAC name of [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine (CID 39199338) is [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine.
What is the SMILES notation for [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine?
The canonical SMILES for [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine is CCOc1ccc(-c2nc3ccc(C)cn3c2CN)cc1.
What is the InChIKey of [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine?
The InChIKey is XQNAJNAPXKJXAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c1-3-21-14-7-5-13(6-8-14)17-15(10-18)20-11-12(2)4-9-16(20)19-17/h4-9,11H,3,10,18H2,1-2H3.
What are the key properties of [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine?
[2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine has a molecular weight of 281.36 g/mol, XLogP of 3.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine is sourced from PubChem (CID 39199338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).