3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine

C23H24N6O — CID 155551652

IUPAC3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine
SMILESCOc1ccc(-c2cnc3cnc(-c4ccc(N5CCN(C)CC5)nc4)cn23)cc1
InChIInChI=1S/C23H24N6O/c1-27-9-11-28(12-10-27)22-8-5-18(13-25-22)20-16-29-21(14-26-23(29)15-24-20)17-3-6-19(30-2)7-4-17/h3-8,13-16H,9-12H2,1-2H3
InChIKeyBUXSQIZCLINOSB-UHFFFAOYSA-N
MW400.49 g/mol
LogP3.22
Rot. Bonds4

About 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine

3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine (PubChem CID 155551652) has the molecular formula C23H24N6O and a molecular weight of 400.49 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine
PubChem CID155551652
Molecular FormulaC23H24N6O
Molecular Weight400.49 g/mol
Exact Mass400.20
IUPAC Name3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine
SMILESCOc1ccc(-c2cnc3cnc(-c4ccc(N5CCN(C)CC5)nc4)cn23)cc1
InChIInChI=1S/C23H24N6O/c1-27-9-11-28(12-10-27)22-8-5-18(13-25-22)20-16-29-21(14-26-23(29)15-24-20)17-3-6-19(30-2)7-4-17/h3-8,13-16H,9-12H2,1-2H3
InChIKeyBUXSQIZCLINOSB-UHFFFAOYSA-N
XLogP3.22
TPSA58.79 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.49
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine?
The IUPAC name of 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine (CID 155551652) is 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine.
What is the SMILES notation for 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine?
The canonical SMILES for 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine is COc1ccc(-c2cnc3cnc(-c4ccc(N5CCN(C)CC5)nc4)cn23)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine?
The InChIKey is BUXSQIZCLINOSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O/c1-27-9-11-28(12-10-27)22-8-5-18(13-25-22)20-16-29-21(14-26-23(29)15-24-20)17-3-6-19(30-2)7-4-17/h3-8,13-16H,9-12H2,1-2H3.
What are the key properties of 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine?
3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine has a molecular weight of 400.49 g/mol, XLogP of 3.22, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine is sourced from PubChem (CID 155551652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).