2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine

C23H26N6O — CID 11682812

IUPAC2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine
SMILESCOc1ccccc1N1CCN(Cc2cn3cc(C)cc(-n4cccn4)c3n2)CC1
InChIInChI=1S/C23H26N6O/c1-18-14-21(29-9-5-8-24-29)23-25-19(17-28(23)15-18)16-26-10-12-27(13-11-26)20-6-3-4-7-22(20)30-2/h3-9,14-15,17H,10-13,16H2,1-2H3
InChIKeyCAVSFHXWRJHLEI-UHFFFAOYSA-N
MW402.50 g/mol
LogP3.16
Rot. Bonds5

About 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine

2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine (PubChem CID 11682812) has the molecular formula C23H26N6O and a molecular weight of 402.50 g/mol. Its IUPAC name is 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine
PubChem CID11682812
Molecular FormulaC23H26N6O
Molecular Weight402.50 g/mol
Exact Mass402.22
IUPAC Name2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine
SMILESCOc1ccccc1N1CCN(Cc2cn3cc(C)cc(-n4cccn4)c3n2)CC1
InChIInChI=1S/C23H26N6O/c1-18-14-21(29-9-5-8-24-29)23-25-19(17-28(23)15-18)16-26-10-12-27(13-11-26)20-6-3-4-7-22(20)30-2/h3-9,14-15,17H,10-13,16H2,1-2H3
InChIKeyCAVSFHXWRJHLEI-UHFFFAOYSA-N
XLogP3.16
TPSA50.83 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.50
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine?
The IUPAC name of 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine (CID 11682812) is 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine is COc1ccccc1N1CCN(Cc2cn3cc(C)cc(-n4cccn4)c3n2)CC1.
What is the InChIKey of 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine?
The InChIKey is CAVSFHXWRJHLEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N6O/c1-18-14-21(29-9-5-8-24-29)23-25-19(17-28(23)15-18)16-26-10-12-27(13-11-26)20-6-3-4-7-22(20)30-2/h3-9,14-15,17H,10-13,16H2,1-2H3.
What are the key properties of 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine?
2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine has a molecular weight of 402.50 g/mol, XLogP of 3.16, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-6-methyl-8-pyrazol-1-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 11682812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).