2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine

C24H26N6O — CID 110311537

IUPAC2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
SMILESCOc1cccc(-c2nc3ccc(N)cn3c2CN2CCN(c3ccccn3)CC2)c1
InChIInChI=1S/C24H26N6O/c1-31-20-6-4-5-18(15-20)24-21(30-16-19(25)8-9-23(30)27-24)17-28-11-13-29(14-12-28)22-7-2-3-10-26-22/h2-10,15-16H,11-14,17,25H2,1H3
InChIKeyJHYHHEMWHILTJE-UHFFFAOYSA-N
MW414.51 g/mol
LogP3.31
Rot. Bonds5

About 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine

2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine (PubChem CID 110311537) has the molecular formula C24H26N6O and a molecular weight of 414.51 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
PubChem CID110311537
Molecular FormulaC24H26N6O
Molecular Weight414.51 g/mol
Exact Mass414.22
IUPAC Name2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
SMILESCOc1cccc(-c2nc3ccc(N)cn3c2CN2CCN(c3ccccn3)CC2)c1
InChIInChI=1S/C24H26N6O/c1-31-20-6-4-5-18(15-20)24-21(30-16-19(25)8-9-23(30)27-24)17-28-11-13-29(14-12-28)22-7-2-3-10-26-22/h2-10,15-16H,11-14,17,25H2,1H3
InChIKeyJHYHHEMWHILTJE-UHFFFAOYSA-N
XLogP3.31
TPSA71.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.51
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(3,4-dichlorophenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 110311535
2-(4-methoxy-3-methylphenyl)-3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 110311561
3-[(4-ethylsulfonylpiperazin-1-yl)methyl]-2-(3-methoxyphenyl)-6-phenylimidazo[1,2-a]pyridine
CID 46114559
2-(3-methoxyphenyl)-6-methyl-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 2759685
1-[4-[[2-(3-methoxyphenyl)-6-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-2-methylpropan-1-one
CID 83286683
(2-chlorophenyl)-[4-[[2-(3-methoxyphenyl)-6-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone
CID 83277085
2-[3-[[4-(cyclobutanecarbonyl)piperazin-1-yl]methyl]-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-6-yl]benzamide
CID 121309737
1-[4-[[6-(2,5-dimethylphenyl)-2-(3-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]propan-1-one
CID 83281400
2-(4-methylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine
CID 165344231
(2-fluorophenyl)-[4-[[2-(3-methoxyphenyl)-6-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]methanone
CID 83274694
3-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-6-(3-nitrophenyl)-2-phenylimidazo[1,2-a]pyridine
CID 83275417
1-(naphthalen-2-ylmethyl)-4-pyridin-2-ylpiperazine
CID 764826

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine?
The IUPAC name of 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine (CID 110311537) is 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine.
What is the SMILES notation for 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine?
The canonical SMILES for 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine is COc1cccc(-c2nc3ccc(N)cn3c2CN2CCN(c3ccccn3)CC2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine?
The InChIKey is JHYHHEMWHILTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N6O/c1-31-20-6-4-5-18(15-20)24-21(30-16-19(25)8-9-23(30)27-24)17-28-11-13-29(14-12-28)22-7-2-3-10-26-22/h2-10,15-16H,11-14,17,25H2,1H3.
What are the key properties of 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine?
2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine has a molecular weight of 414.51 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-3-[(4-pyridin-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-amine is sourced from PubChem (CID 110311537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).