2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol

C24H25N5O2 — CID 126474260

IUPAC2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
SMILESOCCN1CCN(c2nccn3c(-c4ccccc4Oc4ccccc4)cnc23)CC1
InChIInChI=1S/C24H25N5O2/c30-17-16-27-12-14-28(15-13-27)23-24-26-18-21(29(24)11-10-25-23)20-8-4-5-9-22(20)31-19-6-2-1-3-7-19/h1-11,18,30H,12-17H2
InChIKeyLYBUFMPAMZFQPW-UHFFFAOYSA-N
MW415.50 g/mol
LogP3.30
Rot. Bonds6

About 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol

2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol (PubChem CID 126474260) has the molecular formula C24H25N5O2 and a molecular weight of 415.50 g/mol. Its IUPAC name is 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
PubChem CID126474260
Molecular FormulaC24H25N5O2
Molecular Weight415.50 g/mol
Exact Mass415.20
IUPAC Name2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol
SMILESOCCN1CCN(c2nccn3c(-c4ccccc4Oc4ccccc4)cnc23)CC1
InChIInChI=1S/C24H25N5O2/c30-17-16-27-12-14-28(15-13-27)23-24-26-18-21(29(24)11-10-25-23)20-8-4-5-9-22(20)31-19-6-2-1-3-7-19/h1-11,18,30H,12-17H2
InChIKeyLYBUFMPAMZFQPW-UHFFFAOYSA-N
XLogP3.30
TPSA66.13 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.50
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol (CID 126474260) is 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol is OCCN1CCN(c2nccn3c(-c4ccccc4Oc4ccccc4)cnc23)CC1.
What is the InChIKey of 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol?
The InChIKey is LYBUFMPAMZFQPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5O2/c30-17-16-27-12-14-28(15-13-27)23-24-26-18-21(29(24)11-10-25-23)20-8-4-5-9-22(20)31-19-6-2-1-3-7-19/h1-11,18,30H,12-17H2.
What are the key properties of 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol?
2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol has a molecular weight of 415.50 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-(2-phenoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]piperazin-1-yl]ethanol is sourced from PubChem (CID 126474260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).