3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide

C12H12N4O2 — CID 63654288

IUPAC3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide
SMILES[H]/N=C(\N)c1nccnc1Oc1ccccc1CO
InChIInChI=1S/C12H12N4O2/c13-11(14)10-12(16-6-5-15-10)18-9-4-2-1-3-8(9)7-17/h1-6,17H,7H2,(H3,13,14)
InChIKeyUESWYIINAYGRKD-UHFFFAOYSA-N
MW244.25 g/mol
LogP1.05
Rot. Bonds4

About 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide

3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide (PubChem CID 63654288) has the molecular formula C12H12N4O2 and a molecular weight of 244.25 g/mol. Its IUPAC name is 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide.

Molecular Properties

Compound Name3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide
PubChem CID63654288
Molecular FormulaC12H12N4O2
Molecular Weight244.25 g/mol
Exact Mass244.10
IUPAC Name3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide
SMILES[H]/N=C(\N)c1nccnc1Oc1ccccc1CO
InChIInChI=1S/C12H12N4O2/c13-11(14)10-12(16-6-5-15-10)18-9-4-2-1-3-8(9)7-17/h1-6,17H,7H2,(H3,13,14)
InChIKeyUESWYIINAYGRKD-UHFFFAOYSA-N
XLogP1.05
TPSA105.11 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 51.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide with MolForge

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

Launch Full Analysis

Related Compounds

3-chloro-2-[2-(hydroxymethyl)phenoxy]pyridine-4-carboximidamide
CID 107060606
3-(2-tert-butylphenoxy)pyrazine-2-carboximidamide
CID 62683206
3-quinolin-5-yloxypyrazine-2-carboximidamide
CID 103044881
3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboxylic acid
CID 63681353
3-phenoxypyrazine-2-carboximidamide
CID 62683537
[2-(3-aminopyrazin-2-yl)oxyphenyl]methanol
CID 102988200
2-[2-(hydroxymethyl)phenoxy]benzenecarboximidamide
CID 63653288
3-[(2-chlorophenyl)methoxy]pyrazine-2-carboximidamide
CID 62685766
[2-[2-(hydroxymethyl)phenoxy]-3-pyridinyl]methanol
CID 63653116
3-ethoxypyrazine-2-carboximidamide
CID 62685584
3-(3-ethoxyphenoxy)pyrazine-2-carboximidamide
CID 62684399
3-(2-phenoxyethoxy)pyrazine-2-carboximidamide
CID 62684730

Frequently Asked Questions

What is the IUPAC name of 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide?
The IUPAC name of 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide (CID 63654288) is 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide.
What is the SMILES notation for 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide?
The canonical SMILES for 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide is [H]/N=C(\N)c1nccnc1Oc1ccccc1CO.
What is the InChIKey of 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide?
The InChIKey is UESWYIINAYGRKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2/c13-11(14)10-12(16-6-5-15-10)18-9-4-2-1-3-8(9)7-17/h1-6,17H,7H2,(H3,13,14).
What are the key properties of 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide?
3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide has a molecular weight of 244.25 g/mol, XLogP of 1.05, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(hydroxymethyl)phenoxy]pyrazine-2-carboximidamide is sourced from PubChem (CID 63654288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).