2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine

C19H22N4 — CID 117236404

IUPAC2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine
SMILESCc1ccc(Cc2cn3ccc(N4CCNCC4)cc3n2)cc1
InChIInChI=1S/C19H22N4/c1-15-2-4-16(5-3-15)12-17-14-23-9-6-18(13-19(23)21-17)22-10-7-20-8-11-22/h2-6,9,13-14,20H,7-8,10-12H2,1H3
InChIKeyRKPWXLLGBTVUCN-UHFFFAOYSA-N
MW306.41 g/mol
LogP2.64
Rot. Bonds3

About 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine

2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine (PubChem CID 117236404) has the molecular formula C19H22N4 and a molecular weight of 306.41 g/mol. Its IUPAC name is 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine
PubChem CID117236404
Molecular FormulaC19H22N4
Molecular Weight306.41 g/mol
Exact Mass306.18
IUPAC Name2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine
SMILESCc1ccc(Cc2cn3ccc(N4CCNCC4)cc3n2)cc1
InChIInChI=1S/C19H22N4/c1-15-2-4-16(5-3-15)12-17-14-23-9-6-18(13-19(23)21-17)22-10-7-20-8-11-22/h2-6,9,13-14,20H,7-8,10-12H2,1H3
InChIKeyRKPWXLLGBTVUCN-UHFFFAOYSA-N
XLogP2.64
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.41
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(7-piperazin-1-ylimidazo[1,2-a]pyridin-2-yl)propan-1-ol
CID 117236286
7-piperazin-1-yl-2-(thian-4-ylmethyl)imidazo[1,2-a]pyridine
CID 117236324
2-(2-methylphenyl)-7-piperazin-1-ylimidazo[1,2-a]pyridine
CID 117236435
4-methyl-6-[(4-methylphenyl)methyl]-2-piperazin-1-ylpyrimidine
CID 157251381
7-piperazin-1-yl-2-(piperidin-3-ylmethyl)imidazo[1,2-a]pyridine
CID 117236368
N-[[2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-7-yl]methyl]ethanamine
CID 82223213
4-[(7-methylimidazo[1,2-a]pyridin-2-yl)methyl]phenol
CID 117135218
4-[(4-methylphenyl)methyl]-2-piperazin-1-yl-1,3-thiazole;dihydrochloride
CID 3056209
7-piperazin-1-yl-2-(thian-4-yl)imidazo[1,2-a]pyridine
CID 117236308
2-(5-chloro-2,4-dimethoxyphenyl)-7-piperazin-1-ylimidazo[1,2-a]pyridine
CID 135281250
2-[(4-methylphenyl)methyl]imidazo[1,2-a]pyridin-6-amine
CID 82223223
1-[4-[(4-methylsulfanylphenyl)methyl]phenyl]piperazine
CID 4739565

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine?
The IUPAC name of 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine (CID 117236404) is 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine is Cc1ccc(Cc2cn3ccc(N4CCNCC4)cc3n2)cc1.
What is the InChIKey of 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine?
The InChIKey is RKPWXLLGBTVUCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4/c1-15-2-4-16(5-3-15)12-17-14-23-9-6-18(13-19(23)21-17)22-10-7-20-8-11-22/h2-6,9,13-14,20H,7-8,10-12H2,1H3.
What are the key properties of 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine?
2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine has a molecular weight of 306.41 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methylphenyl)methyl]-7-piperazin-1-ylimidazo[1,2-a]pyridine is sourced from PubChem (CID 117236404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).