2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine

C28H32N4O2 — CID 23625541

IUPAC2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine
SMILESCOc1ccccc1N1CCN(CCCOc2ccc(-c3cn4cccc(C)c4n3)cc2)CC1
InChIInChI=1S/C28H32N4O2/c1-22-7-5-15-32-21-25(29-28(22)32)23-10-12-24(13-11-23)34-20-6-14-30-16-18-31(19-17-30)26-8-3-4-9-27(26)33-2/h3-5,7-13,15,21H,6,14,16-20H2,1-2H3
InChIKeyWMZWVTIIHJJKKR-UHFFFAOYSA-N
MW456.59 g/mol
LogP4.91
Rot. Bonds8

About 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine

2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine (PubChem CID 23625541) has the molecular formula C28H32N4O2 and a molecular weight of 456.59 g/mol. Its IUPAC name is 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine
PubChem CID23625541
Molecular FormulaC28H32N4O2
Molecular Weight456.59 g/mol
Exact Mass456.25
IUPAC Name2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine
SMILESCOc1ccccc1N1CCN(CCCOc2ccc(-c3cn4cccc(C)c4n3)cc2)CC1
InChIInChI=1S/C28H32N4O2/c1-22-7-5-15-32-21-25(29-28(22)32)23-10-12-24(13-11-23)34-20-6-14-30-16-18-31(19-17-30)26-8-3-4-9-27(26)33-2/h3-5,7-13,15,21H,6,14,16-20H2,1-2H3
InChIKeyWMZWVTIIHJJKKR-UHFFFAOYSA-N
XLogP4.91
TPSA42.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500456.59
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[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

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine?
The IUPAC name of 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine (CID 23625541) is 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine?
The canonical SMILES for 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine is COc1ccccc1N1CCN(CCCOc2ccc(-c3cn4cccc(C)c4n3)cc2)CC1.
What is the InChIKey of 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine?
The InChIKey is WMZWVTIIHJJKKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H32N4O2/c1-22-7-5-15-32-21-25(29-28(22)32)23-10-12-24(13-11-23)34-20-6-14-30-16-18-31(19-17-30)26-8-3-4-9-27(26)33-2/h3-5,7-13,15,21H,6,14,16-20H2,1-2H3.
What are the key properties of 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine?
2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine has a molecular weight of 456.59 g/mol, XLogP of 4.91, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propoxy]phenyl]-8-methylimidazo[1,2-a]pyridine is sourced from PubChem (CID 23625541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).