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

C9H11N3O2 — CID 58436622

IUPAC[5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol
SMILESCc1cnc2c(n1)c(CO)cn2CO
InChIInChI=1S/C9H11N3O2/c1-6-2-10-9-8(11-6)7(4-13)3-12(9)5-14/h2-3,13-14H,4-5H2,1H3
InChIKeyFASDZBYATGWRLQ-UHFFFAOYSA-N
MW193.21 g/mol
LogP0.18
Rot. Bonds2

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

[5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol (PubChem CID 58436622) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol.

Molecular Properties

Compound Name[5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol
PubChem CID58436622
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name[5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol
SMILESCc1cnc2c(n1)c(CO)cn2CO
InChIInChI=1S/C9H11N3O2/c1-6-2-10-9-8(11-6)7(4-13)3-12(9)5-14/h2-3,13-14H,4-5H2,1H3
InChIKeyFASDZBYATGWRLQ-UHFFFAOYSA-N
XLogP0.18
TPSA71.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 50.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol?
The IUPAC name of [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol (CID 58436622) is [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol.
What is the SMILES notation for [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol?
The canonical SMILES for [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol is Cc1cnc2c(n1)c(CO)cn2CO.
What is the InChIKey of [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol?
The InChIKey is FASDZBYATGWRLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c1-6-2-10-9-8(11-6)7(4-13)3-12(9)5-14/h2-3,13-14H,4-5H2,1H3.
What are the key properties of [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol?
[5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol has a molecular weight of 193.21 g/mol, XLogP of 0.18, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(hydroxymethyl)-2-methylpyrrolo[2,3-b]pyrazin-7-yl]methanol is sourced from PubChem (CID 58436622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).