[5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol

C8H9N3O2 — CID 58522359

IUPAC[5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol
SMILESOCc1cn(CO)c2nccnc12
InChIInChI=1S/C8H9N3O2/c12-4-6-3-11(5-13)8-7(6)9-1-2-10-8/h1-3,12-13H,4-5H2
InChIKeyBQNVZGCPLYPISN-UHFFFAOYSA-N
MW179.18 g/mol
LogP-0.13
Rot. Bonds2

About [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol

[5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol (PubChem CID 58522359) has the molecular formula C8H9N3O2 and a molecular weight of 179.18 g/mol. Its IUPAC name is [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol.

Molecular Properties

Compound Name[5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol
PubChem CID58522359
Molecular FormulaC8H9N3O2
Molecular Weight179.18 g/mol
Exact Mass179.07
IUPAC Name[5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol
SMILESOCc1cn(CO)c2nccnc12
InChIInChI=1S/C8H9N3O2/c12-4-6-3-11(5-13)8-7(6)9-1-2-10-8/h1-3,12-13H,4-5H2
InChIKeyBQNVZGCPLYPISN-UHFFFAOYSA-N
XLogP-0.13
TPSA71.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.18
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol?
The IUPAC name of [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol (CID 58522359) is [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol.
What is the SMILES notation for [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol?
The canonical SMILES for [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol is OCc1cn(CO)c2nccnc12.
What is the InChIKey of [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol?
The InChIKey is BQNVZGCPLYPISN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3O2/c12-4-6-3-11(5-13)8-7(6)9-1-2-10-8/h1-3,12-13H,4-5H2.
What are the key properties of [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol?
[5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol has a molecular weight of 179.18 g/mol, XLogP of -0.13, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(hydroxymethyl)pyrrolo[2,3-b]pyrazin-7-yl]methanol is sourced from PubChem (CID 58522359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).