[2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine

C16H17N3O2 — CID 82059827

IUPAC[2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine
SMILESCOc1ccc(-c2cn3cccc(CN)c3n2)cc1OC
InChIInChI=1S/C16H17N3O2/c1-20-14-6-5-11(8-15(14)21-2)13-10-19-7-3-4-12(9-17)16(19)18-13/h3-8,10H,9,17H2,1-2H3
InChIKeyVFJPPUDOVQIGDI-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.48
Rot. Bonds4

About [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine

[2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine (PubChem CID 82059827) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine.

Molecular Properties

Compound Name[2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine
PubChem CID82059827
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name[2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine
SMILESCOc1ccc(-c2cn3cccc(CN)c3n2)cc1OC
InChIInChI=1S/C16H17N3O2/c1-20-14-6-5-11(8-15(14)21-2)13-10-19-7-3-4-12(9-17)16(19)18-13/h3-8,10H,9,17H2,1-2H3
InChIKeyVFJPPUDOVQIGDI-UHFFFAOYSA-N
XLogP2.48
TPSA61.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine?
The IUPAC name of [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine (CID 82059827) is [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine.
What is the SMILES notation for [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine?
The canonical SMILES for [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine is COc1ccc(-c2cn3cccc(CN)c3n2)cc1OC.
What is the InChIKey of [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine?
The InChIKey is VFJPPUDOVQIGDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-20-14-6-5-11(8-15(14)21-2)13-10-19-7-3-4-12(9-17)16(19)18-13/h3-8,10H,9,17H2,1-2H3.
What are the key properties of [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine?
[2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine has a molecular weight of 283.33 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-8-yl]methanamine is sourced from PubChem (CID 82059827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).