6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine

C26H30N4 — CID 144747931

IUPAC6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc(-c2nc3ccc(C4=CCCC=C4)cn3c2CN2CCN(C)CC2)cc1
InChIInChI=1S/C26H30N4/c1-20-8-10-22(11-9-20)26-24(19-29-16-14-28(2)15-17-29)30-18-23(12-13-25(30)27-26)21-6-4-3-5-7-21/h4,6-13,18H,3,5,14-17,19H2,1-2H3
InChIKeyXEVRFPYIVXMLBZ-UHFFFAOYSA-N
MW398.55 g/mol
LogP4.79
Rot. Bonds4

About 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine

6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine (PubChem CID 144747931) has the molecular formula C26H30N4 and a molecular weight of 398.55 g/mol. Its IUPAC name is 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
PubChem CID144747931
Molecular FormulaC26H30N4
Molecular Weight398.55 g/mol
Exact Mass398.25
IUPAC Name6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
SMILESCc1ccc(-c2nc3ccc(C4=CCCC=C4)cn3c2CN2CCN(C)CC2)cc1
InChIInChI=1S/C26H30N4/c1-20-8-10-22(11-9-20)26-24(19-29-16-14-28(2)15-17-29)30-18-23(12-13-25(30)27-26)21-6-4-3-5-7-21/h4,6-13,18H,3,5,14-17,19H2,1-2H3
InChIKeyXEVRFPYIVXMLBZ-UHFFFAOYSA-N
XLogP4.79
TPSA23.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.55
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-prop-2-enylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine
CID 144748059
2-(4-methylphenyl)-3-(piperidin-1-ylmethyl)imidazo[1,2-a]pyridin-6-amine
CID 165344231
2-[2-(4-methylphenyl)-3-[(4-prop-1-en-2-ylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridin-6-yl]cyclohexa-1,3-diene-1-carbonitrile
CID 144747984
2-(4-methoxyphenyl)-3-[(4-methyl-1,4-diazepan-1-yl)methyl]-6-pyridin-4-ylimidazo[1,2-a]pyridine
CID 66556604
3-(1,4-diazepan-1-ylmethyl)-2-(4-methoxyphenyl)-6-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 66555929
(3S)-3-[4-[(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)methyl]piperazin-1-yl]thiolane 1,1-dioxide
CID 30693470
1-[4-[[6-(4-acetylphenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-3-methylbutan-1-one
CID 83272328
1-[4-[2-(4-methylphenyl)-3-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]imidazo[1,2-a]pyridin-6-yl]phenyl]ethanone
CID 83272329
3-[[4-(cyclopentylmethyl)piperazin-1-yl]methyl]-2-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 155082855
2-(4-methylphenyl)-3-(piperazin-1-ylmethyl)imidazo[1,2-a]pyridine
CID 2760437
1-[4-[[6-(2,5-dimethylphenyl)-2-phenylimidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]propan-1-one
CID 83281402
[4-[[6-(2-chlorophenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methyl]piperazin-1-yl]-cyclobutylmethanone
CID 83288509

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The IUPAC name of 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine (CID 144747931) is 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine is Cc1ccc(-c2nc3ccc(C4=CCCC=C4)cn3c2CN2CCN(C)CC2)cc1.
What is the InChIKey of 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
The InChIKey is XEVRFPYIVXMLBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N4/c1-20-8-10-22(11-9-20)26-24(19-29-16-14-28(2)15-17-29)30-18-23(12-13-25(30)27-26)21-6-4-3-5-7-21/h4,6-13,18H,3,5,14-17,19H2,1-2H3.
What are the key properties of 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine?
6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine has a molecular weight of 398.55 g/mol, XLogP of 4.79, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexa-1,5-dien-1-yl-2-(4-methylphenyl)-3-[(4-methylpiperazin-1-yl)methyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 144747931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).