3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine

C25H25N7 — CID 155559952

IUPAC3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine
SMILESCN1CCN(c2ccc(-c3cn4c(-c5ccc6c(ccn6C)c5)cnc4cn3)cn2)CC1
InChIInChI=1S/C25H25N7/c1-29-9-11-31(12-10-29)24-6-4-20(14-27-24)21-17-32-23(15-28-25(32)16-26-21)18-3-5-22-19(13-18)7-8-30(22)2/h3-8,13-17H,9-12H2,1-2H3
InChIKeyOOEKMWGUJMVGJN-UHFFFAOYSA-N
MW423.52 g/mol
LogP3.70
Rot. Bonds3

About 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine

3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine (PubChem CID 155559952) has the molecular formula C25H25N7 and a molecular weight of 423.52 g/mol. Its IUPAC name is 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine.

Molecular Properties

Compound Name3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine
PubChem CID155559952
Molecular FormulaC25H25N7
Molecular Weight423.52 g/mol
Exact Mass423.22
IUPAC Name3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine
SMILESCN1CCN(c2ccc(-c3cn4c(-c5ccc6c(ccn6C)c5)cnc4cn3)cn2)CC1
InChIInChI=1S/C25H25N7/c1-29-9-11-31(12-10-29)24-6-4-20(14-27-24)21-17-32-23(15-28-25(32)16-26-21)18-3-5-22-19(13-18)7-8-30(22)2/h3-8,13-17H,9-12H2,1-2H3
InChIKeyOOEKMWGUJMVGJN-UHFFFAOYSA-N
XLogP3.70
TPSA54.49 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.52
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine?
The IUPAC name of 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine (CID 155559952) is 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine.
What is the SMILES notation for 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine?
The canonical SMILES for 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine is CN1CCN(c2ccc(-c3cn4c(-c5ccc6c(ccn6C)c5)cnc4cn3)cn2)CC1.
What is the InChIKey of 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine?
The InChIKey is OOEKMWGUJMVGJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25N7/c1-29-9-11-31(12-10-29)24-6-4-20(14-27-24)21-17-32-23(15-28-25(32)16-26-21)18-3-5-22-19(13-18)7-8-30(22)2/h3-8,13-17H,9-12H2,1-2H3.
What are the key properties of 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine?
3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine has a molecular weight of 423.52 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylindol-5-yl)-6-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]imidazo[1,2-a]pyrazine is sourced from PubChem (CID 155559952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).