2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine

C18H21N3O — CID 82030337

IUPAC2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
SMILESCOc1ccc(-c2nc3ccccn3c2C(C)CN)cc1C
InChIInChI=1S/C18H21N3O/c1-12-10-14(7-8-15(12)22-3)17-18(13(2)11-19)21-9-5-4-6-16(21)20-17/h4-10,13H,11,19H2,1-3H3
InChIKeyBTCSOSISAGBRKN-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.38
Rot. Bonds4

About 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine

2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine (PubChem CID 82030337) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine.

Molecular Properties

Compound Name2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
PubChem CID82030337
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
SMILESCOc1ccc(-c2nc3ccccn3c2C(C)CN)cc1C
InChIInChI=1S/C18H21N3O/c1-12-10-14(7-8-15(12)22-3)17-18(13(2)11-19)21-9-5-4-6-16(21)20-17/h4-10,13H,11,19H2,1-3H3
InChIKeyBTCSOSISAGBRKN-UHFFFAOYSA-N
XLogP3.38
TPSA52.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 39127534
2-[7-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 82030409
1-[2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-ol
CID 82029535
2-[2-(4-methoxy-3-methylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanethioamide
CID 82030222
1-[2-(4-methoxy-3-methylphenyl)-8-methylimidazo[1,2-a]pyridin-3-yl]ethanol
CID 82029446
3-(chloromethyl)-2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine
CID 39132917
2-(4-methoxy-3-methylphenyl)-5-methylimidazo[1,2-a]pyridin-3-amine
CID 63618111
2-(4-methoxy-3-propan-2-ylphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356275
2-[2-(3,4-dimethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 39127548
2-[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 82030415
3-(chloromethyl)-2-(4-methoxy-3-methylphenyl)-8-methylimidazo[1,2-a]pyridine
CID 39126375
1-[2-(4-methoxy-3-methylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine
CID 39145993

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The IUPAC name of 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine (CID 82030337) is 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine.
What is the SMILES notation for 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The canonical SMILES for 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine is COc1ccc(-c2nc3ccccn3c2C(C)CN)cc1C.
What is the InChIKey of 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
The InChIKey is BTCSOSISAGBRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-12-10-14(7-8-15(12)22-3)17-18(13(2)11-19)21-9-5-4-6-16(21)20-17/h4-10,13H,11,19H2,1-3H3.
What are the key properties of 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine?
2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine has a molecular weight of 295.39 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxy-3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine is sourced from PubChem (CID 82030337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).