3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide

C13H14N4O2 — CID 62685242

IUPAC3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide
SMILES[H]/N=C(\N)c1nccnc1OCc1cccc(OC)c1
InChIInChI=1S/C13H14N4O2/c1-18-10-4-2-3-9(7-10)8-19-13-11(12(14)15)16-5-6-17-13/h2-7H,8H2,1H3,(H3,14,15)
InChIKeyBZGUMNMXEICUBE-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.35
Rot. Bonds5

About 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide

3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide (PubChem CID 62685242) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide.

Molecular Properties

Compound Name3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide
PubChem CID62685242
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide
SMILES[H]/N=C(\N)c1nccnc1OCc1cccc(OC)c1
InChIInChI=1S/C13H14N4O2/c1-18-10-4-2-3-9(7-10)8-19-13-11(12(14)15)16-5-6-17-13/h2-7H,8H2,1H3,(H3,14,15)
InChIKeyBZGUMNMXEICUBE-UHFFFAOYSA-N
XLogP1.35
TPSA94.11 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-[(3-methoxyphenyl)methoxy]-5,6-dimethylpyridazine-4-carboximidamide
CID 61090301
2-[(3-methoxyphenyl)methoxy]benzenecarboximidamide
CID 24694243
3-[[(3-methoxyphenyl)methyl-methylamino]methyl]pyridine-2-carboximidamide
CID 62894551
3-(3-ethoxyphenoxy)pyrazine-2-carboximidamide
CID 62684399
2-[(3-methoxyphenyl)methoxy]pyridin-3-amine
CID 24708484
3-(2-phenoxyethoxy)pyrazine-2-carboximidamide
CID 62684730
4-chloro-2-[(3-methoxyphenyl)methoxy]benzenecarboximidamide
CID 63092175
3-chloro-4-[(3-methoxyphenyl)methoxy]benzenecarboximidamide
CID 61388847
3-ethoxypyrazine-2-carboximidamide
CID 62685584
3-[(3-methoxyphenyl)methoxy]pyrazine-2-carbonitrile
CID 55104413
3-phenoxypyrazine-2-carboximidamide
CID 62683537
3-[(3-methoxyphenyl)methoxy]pyridazine-4-carbothioamide
CID 80512658

Frequently Asked Questions

What is the IUPAC name of 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide?
The IUPAC name of 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide (CID 62685242) is 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide.
What is the SMILES notation for 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide?
The canonical SMILES for 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide is [H]/N=C(\N)c1nccnc1OCc1cccc(OC)c1.
What is the InChIKey of 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide?
The InChIKey is BZGUMNMXEICUBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-18-10-4-2-3-9(7-10)8-19-13-11(12(14)15)16-5-6-17-13/h2-7H,8H2,1H3,(H3,14,15).
What are the key properties of 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide?
3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide has a molecular weight of 258.28 g/mol, XLogP of 1.35, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-methoxyphenyl)methoxy]pyrazine-2-carboximidamide is sourced from PubChem (CID 62685242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).