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

C18H21N3O — CID 39199352

IUPAC[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCCCOc1ccc(-c2nc3cc(C)ccn3c2CN)cc1
InChIInChI=1S/C18H21N3O/c1-3-10-22-15-6-4-14(5-7-15)18-16(12-19)21-9-8-13(2)11-17(21)20-18/h4-9,11H,3,10,12,19H2,1-2H3
InChIKeyXNYLFGVHNQFCQV-UHFFFAOYSA-N
MW295.39 g/mol
LogP3.56
Rot. Bonds5

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

[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine (PubChem CID 39199352) has the molecular formula C18H21N3O and a molecular weight of 295.39 g/mol. Its IUPAC name is [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
PubChem CID39199352
Molecular FormulaC18H21N3O
Molecular Weight295.39 g/mol
Exact Mass295.17
IUPAC Name[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCCCOc1ccc(-c2nc3cc(C)ccn3c2CN)cc1
InChIInChI=1S/C18H21N3O/c1-3-10-22-15-6-4-14(5-7-15)18-16(12-19)21-9-8-13(2)11-17(21)20-18/h4-9,11H,3,10,12,19H2,1-2H3
InChIKeyXNYLFGVHNQFCQV-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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Related Compounds

3-[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanoic acid
CID 82035102
2-[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 82030415
[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 82059872
(E)-3-[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]prop-2-enoic acid
CID 39195944
N-butyl-N-[3-[4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)phenoxy]propyl]butan-1-amine
CID 14773969
[2-(4-ethoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199332
[2-(4-ethoxyphenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199338
2-(4-bromophenyl)-3-ethyl-7-methylimidazo[1,2-a]pyridine
CID 100820877
3-(chloromethyl)-2-(4-chlorophenyl)-7-methylimidazo[1,2-a]pyridine
CID 39133020
ethyl 2-amino-3-[7-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]propanoate
CID 170885569
2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
CID 82030016
1-[2-(4-ethylphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]-N,N-dimethylmethanamine;dihydrochloride
CID 75537301

Frequently Asked Questions

What is the IUPAC name of [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The IUPAC name of [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine (CID 39199352) is [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine.
What is the SMILES notation for [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The canonical SMILES for [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine is CCCOc1ccc(-c2nc3cc(C)ccn3c2CN)cc1.
What is the InChIKey of [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The InChIKey is XNYLFGVHNQFCQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O/c1-3-10-22-15-6-4-14(5-7-15)18-16(12-19)21-9-8-13(2)11-17(21)20-18/h4-9,11H,3,10,12,19H2,1-2H3.
What are the key properties of [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine?
[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-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 [7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine is sourced from PubChem (CID 39199352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).