[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol

C13H12N4O2 — CID 80872480

IUPAC[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
SMILESNc1cn2ccnc2c(Oc2cccc(CO)c2)n1
InChIInChI=1S/C13H12N4O2/c14-11-7-17-5-4-15-12(17)13(16-11)19-10-3-1-2-9(6-10)8-18/h1-7,18H,8,14H2
InChIKeyRJFVPLJRUIUEQQ-UHFFFAOYSA-N
MW256.27 g/mol
LogP1.60
Rot. Bonds3

About [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol

[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol (PubChem CID 80872480) has the molecular formula C13H12N4O2 and a molecular weight of 256.27 g/mol. Its IUPAC name is [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol.

Molecular Properties

Compound Name[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
PubChem CID80872480
Molecular FormulaC13H12N4O2
Molecular Weight256.27 g/mol
Exact Mass256.10
IUPAC Name[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol
SMILESNc1cn2ccnc2c(Oc2cccc(CO)c2)n1
InChIInChI=1S/C13H12N4O2/c14-11-7-17-5-4-15-12(17)13(16-11)19-10-3-1-2-9(6-10)8-18/h1-7,18H,8,14H2
InChIKeyRJFVPLJRUIUEQQ-UHFFFAOYSA-N
XLogP1.60
TPSA85.67 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.27
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol?
The IUPAC name of [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol (CID 80872480) is [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol.
What is the SMILES notation for [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol?
The canonical SMILES for [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol is Nc1cn2ccnc2c(Oc2cccc(CO)c2)n1.
What is the InChIKey of [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol?
The InChIKey is RJFVPLJRUIUEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O2/c14-11-7-17-5-4-15-12(17)13(16-11)19-10-3-1-2-9(6-10)8-18/h1-7,18H,8,14H2.
What are the key properties of [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol?
[3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol has a molecular weight of 256.27 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(6-aminoimidazo[1,2-a]pyrazin-8-yl)oxyphenyl]methanol is sourced from PubChem (CID 80872480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).