[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine

C18H21N3O — CID 82059872

IUPAC[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
SMILESCCCOc1ccc(-c2nc3cc(CN)ccn3c2C)cc1
InChIInChI=1S/C18H21N3O/c1-3-10-22-16-6-4-15(5-7-16)18-13(2)21-9-8-14(12-19)11-17(21)20-18/h4-9,11H,3,10,12,19H2,1-2H3
InChIKeyHORPFWSZOMIALT-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.56
Rot. Bonds5

About [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine

[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine (PubChem CID 82059872) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine.

Molecular Properties

Compound Name[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
PubChem CID82059872
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
SMILESCCCOc1ccc(-c2nc3cc(CN)ccn3c2C)cc1
InChIInChI=1S/C18H21N3O/c1-3-10-22-16-6-4-15(5-7-16)18-13(2)21-9-8-14(12-19)11-17(21)20-18/h4-9,11H,3,10,12,19H2,1-2H3
InChIKeyHORPFWSZOMIALT-UHFFFAOYSA-N
XLogP3.56
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The IUPAC name of [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine (CID 82059872) is [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine.
What is the SMILES notation for [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The canonical SMILES for [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine is CCCOc1ccc(-c2nc3cc(CN)ccn3c2C)cc1.
What is the InChIKey of [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
The InChIKey is HORPFWSZOMIALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-3-10-22-16-6-4-15(5-7-16)18-13(2)21-9-8-14(12-19)11-17(21)20-18/h4-9,11H,3,10,12,19H2,1-2H3.
What are the key properties of [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine?
[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine has a molecular weight of 295.39 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine is sourced from PubChem (CID 82059872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).