2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine

C22H24N6O — CID 11689612

IUPAC2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine
SMILESCOc1ccccc1N1CCN(Cc2cn3c(-n4cccn4)cccc3n2)CC1
InChIInChI=1S/C22H24N6O/c1-29-20-7-3-2-6-19(20)26-14-12-25(13-15-26)16-18-17-27-21(24-18)8-4-9-22(27)28-11-5-10-23-28/h2-11,17H,12-16H2,1H3
InChIKeyBZHJMSJFFNOURP-UHFFFAOYSA-N
MW388.48 g/mol
LogP2.85
Rot. Bonds5

About 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine

2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine (PubChem CID 11689612) has the molecular formula C22H24N6O and a molecular weight of 388.48 g/mol. Its IUPAC name is 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine
PubChem CID11689612
Molecular FormulaC22H24N6O
Molecular Weight388.48 g/mol
Exact Mass388.20
IUPAC Name2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine
SMILESCOc1ccccc1N1CCN(Cc2cn3c(-n4cccn4)cccc3n2)CC1
InChIInChI=1S/C22H24N6O/c1-29-20-7-3-2-6-19(20)26-14-12-25(13-15-26)16-18-17-27-21(24-18)8-4-9-22(27)28-11-5-10-23-28/h2-11,17H,12-16H2,1H3
InChIKeyBZHJMSJFFNOURP-UHFFFAOYSA-N
XLogP2.85
TPSA50.83 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.48
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

Methyl substituted pyrazole, 27
CID 23648674
9-Cyclopentyl-6-(2-(3-imidazol-1-yl-propoxy)-phenylamino)-9H-purine-2-carbonitrile
CID 11464526
3-(4-methoxyphenyl)-~{N}-[(3~{R})-1-pyridin-4-ylpyrrolidin-3-yl]-[1,2,3]triazolo[4,5-d]pyrimidin-5-amine
CID 86278982
trans-N-[3-(4-methoxy-phenyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-5-yl]-cyclohexane-1,4-diamine
CID 90389602
1-(5-Fluoro-2-methoxyphenyl)-4-[1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazine
CID 72547759
N-[(3S,4S)-4-fluoropyrrolidin-3-yl]-6-(6-methoxyimidazo[1,2-a]pyridin-3-yl)pyridin-2-amine
CID 163752818
2,3-Dimethyl-6-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)imidazo[1,2-b]pyridazine
CID 72706803
2-Ethyl-3-methyl-6-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)imidazo[1,2-b]pyridazine
CID 72706865
2-Methyl-6-((6-(pyrrolidin-1-yl)pyridin-2-yl)methoxy)imidazo[1,2-b]pyridazine
CID 72706867
4-[(1E)-{2-[1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]hydrazin-1-ylidene}methyl]pyridine
CID 91582777
US10399985, Example 35
CID 118278137
US10399985, Example 32
CID 118278218

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine?
The IUPAC name of 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine (CID 11689612) is 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine is COc1ccccc1N1CCN(Cc2cn3c(-n4cccn4)cccc3n2)CC1.
What is the InChIKey of 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine?
The InChIKey is BZHJMSJFFNOURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N6O/c1-29-20-7-3-2-6-19(20)26-14-12-25(13-15-26)16-18-17-27-21(24-18)8-4-9-22(27)28-11-5-10-23-28/h2-11,17H,12-16H2,1H3.
What are the key properties of 2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine?
2-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-5-pyrazol-1-ylimidazo[1,2-a]pyridine has a molecular weight of 388.48 g/mol, XLogP of 2.85, 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]-5-pyrazol-1-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 11689612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).