2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine

C18H21N3 — CID 28912979

IUPAC2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine
SMILESCc1ccc2nc(CCN)c(-c3ccc(C)c(C)c3)n2c1
InChIInChI=1S/C18H21N3/c1-12-4-7-17-20-16(8-9-19)18(21(17)11-12)15-6-5-13(2)14(3)10-15/h4-7,10-11H,8-9,19H2,1-3H3
InChIKeyFBMMYZPRLLIUTK-UHFFFAOYSA-N
MW279.39 g/mol
LogP3.43
Rot. Bonds3

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

2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine (PubChem CID 28912979) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine.

Molecular Properties

Compound Name2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine
PubChem CID28912979
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC Name2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine
SMILESCc1ccc2nc(CCN)c(-c3ccc(C)c(C)c3)n2c1
InChIInChI=1S/C18H21N3/c1-12-4-7-17-20-16(8-9-19)18(21(17)11-12)15-6-5-13(2)14(3)10-15/h4-7,10-11H,8-9,19H2,1-3H3
InChIKeyFBMMYZPRLLIUTK-UHFFFAOYSA-N
XLogP3.43
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine?
The IUPAC name of 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine (CID 28912979) is 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine.
What is the SMILES notation for 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine?
The canonical SMILES for 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine is Cc1ccc2nc(CCN)c(-c3ccc(C)c(C)c3)n2c1.
What is the InChIKey of 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine?
The InChIKey is FBMMYZPRLLIUTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-12-4-7-17-20-16(8-9-19)18(21(17)11-12)15-6-5-13(2)14(3)10-15/h4-7,10-11H,8-9,19H2,1-3H3.
What are the key properties of 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine?
2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine has a molecular weight of 279.39 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridin-2-yl]ethanamine is sourced from PubChem (CID 28912979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).