6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline

C26H24N6 — CID 155544865

IUPAC6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline
SMILESCN1CCN(c2ccc(-c3cn4c(-c5ccc6ncccc6c5)cnc4cn3)cc2)CC1
InChIInChI=1S/C26H24N6/c1-30-11-13-31(14-12-30)22-7-4-19(5-8-22)24-18-32-25(16-29-26(32)17-28-24)21-6-9-23-20(15-21)3-2-10-27-23/h2-10,15-18H,11-14H2,1H3
InChIKeyZBHYWPXDQOVTKU-UHFFFAOYSA-N
MW420.52 g/mol
LogP4.36
Rot. Bonds3

About 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline

6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline (PubChem CID 155544865) has the molecular formula C26H24N6 and a molecular weight of 420.52 g/mol. Its IUPAC name is 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline.

Molecular Properties

Compound Name6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline
PubChem CID155544865
Molecular FormulaC26H24N6
Molecular Weight420.52 g/mol
Exact Mass420.21
IUPAC Name6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline
SMILESCN1CCN(c2ccc(-c3cn4c(-c5ccc6ncccc6c5)cnc4cn3)cc2)CC1
InChIInChI=1S/C26H24N6/c1-30-11-13-31(14-12-30)22-7-4-19(5-8-22)24-18-32-25(16-29-26(32)17-28-24)21-6-9-23-20(15-21)3-2-10-27-23/h2-10,15-18H,11-14H2,1H3
InChIKeyZBHYWPXDQOVTKU-UHFFFAOYSA-N
XLogP4.36
TPSA49.56 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.52
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline?
The IUPAC name of 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline (CID 155544865) is 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline.
What is the SMILES notation for 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline?
The canonical SMILES for 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline is CN1CCN(c2ccc(-c3cn4c(-c5ccc6ncccc6c5)cnc4cn3)cc2)CC1.
What is the InChIKey of 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline?
The InChIKey is ZBHYWPXDQOVTKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24N6/c1-30-11-13-31(14-12-30)22-7-4-19(5-8-22)24-18-32-25(16-29-26(32)17-28-24)21-6-9-23-20(15-21)3-2-10-27-23/h2-10,15-18H,11-14H2,1H3.
What are the key properties of 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline?
6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline has a molecular weight of 420.52 g/mol, XLogP of 4.36, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-[4-(4-methylpiperazin-1-yl)phenyl]imidazo[1,2-a]pyrazin-3-yl]quinoline is sourced from PubChem (CID 155544865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).