2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine

C16H18N4O — CID 63618310

IUPAC2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine
SMILESCOc1cccc(-c2nc3ccc(N(C)C)cn3c2N)c1
InChIInChI=1S/C16H18N4O/c1-19(2)12-7-8-14-18-15(16(17)20(14)10-12)11-5-4-6-13(9-11)21-3/h4-10H,17H2,1-3H3
InChIKeyPUQUAWWJYOSJGE-UHFFFAOYSA-N
MW282.35 g/mol
LogP2.66
Rot. Bonds3

About 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine

2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine (PubChem CID 63618310) has the molecular formula C16H18N4O and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine
PubChem CID63618310
Molecular FormulaC16H18N4O
Molecular Weight282.35 g/mol
Exact Mass282.15
IUPAC Name2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine
SMILESCOc1cccc(-c2nc3ccc(N(C)C)cn3c2N)c1
InChIInChI=1S/C16H18N4O/c1-19(2)12-7-8-14-18-15(16(17)20(14)10-12)11-5-4-6-13(9-11)21-3/h4-10H,17H2,1-3H3
InChIKeyPUQUAWWJYOSJGE-UHFFFAOYSA-N
XLogP2.66
TPSA55.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine?
The IUPAC name of 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine (CID 63618310) is 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine.
What is the SMILES notation for 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine?
The canonical SMILES for 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine is COc1cccc(-c2nc3ccc(N(C)C)cn3c2N)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine?
The InChIKey is PUQUAWWJYOSJGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O/c1-19(2)12-7-8-14-18-15(16(17)20(14)10-12)11-5-4-6-13(9-11)21-3/h4-10H,17H2,1-3H3.
What are the key properties of 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine?
2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine has a molecular weight of 282.35 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-6-N,6-N-dimethylimidazo[1,2-a]pyridine-3,6-diamine is sourced from PubChem (CID 63618310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).