2-(dimethoxymethyl)pyrazine

C7H10N2O2 — CID 91367678

IUPAC2-(dimethoxymethyl)pyrazine
SMILESCOC(OC)c1cnccn1
InChIInChI=1S/C7H10N2O2/c1-10-7(11-2)6-5-8-3-4-9-6/h3-5,7H,1-2H3
InChIKeyNIBJCESTFHTYHN-UHFFFAOYSA-N
MW154.17 g/mol
LogP0.77
Rot. Bonds3

About 2-(dimethoxymethyl)pyrazine

2-(dimethoxymethyl)pyrazine (PubChem CID 91367678) has the molecular formula C7H10N2O2 and a molecular weight of 154.17 g/mol. Its IUPAC name is 2-(dimethoxymethyl)pyrazine.

Molecular Properties

Compound Name2-(dimethoxymethyl)pyrazine
PubChem CID91367678
Molecular FormulaC7H10N2O2
Molecular Weight154.17 g/mol
Exact Mass154.07
IUPAC Name2-(dimethoxymethyl)pyrazine
SMILESCOC(OC)c1cnccn1
InChIInChI=1S/C7H10N2O2/c1-10-7(11-2)6-5-8-3-4-9-6/h3-5,7H,1-2H3
InChIKeyNIBJCESTFHTYHN-UHFFFAOYSA-N
XLogP0.77
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-Methoxy-(3,5 or 6)-methylpyrazine
CID 113204
Pyrazine, 2-methoxymethyl-5-methyl-, 4-oxide
CID 3068148
Pyrazine, 2-(ethoxymethyl)-5-methyl-, 4-oxide
CID 3068149
Pyrazine, 2-ethoxymethyl-
CID 103404
(5-Methylpyrazin-2-yl)methyl acetate
CID 14532641
Methyl pyrazine-2-carboximidate
CID 470894
Pyrazin-2-ylmethyl acetate
CID 12933345
(6-Methylpyrazin-2-yl)methyl acetate
CID 13123637
2,5-Bis(methoxymethyl)pyrazine
CID 14257640
2-(Prop-2-ynoxymethyl)pyrazine
CID 14531221
2-Dihydroxy methylpyrazine
CID 57059322
Methoxypyrazin-2-ylmethanimine, hydrochloride
CID 470893

Frequently Asked Questions

What is the IUPAC name of 2-(dimethoxymethyl)pyrazine?
The IUPAC name of 2-(dimethoxymethyl)pyrazine (CID 91367678) is 2-(dimethoxymethyl)pyrazine.
What is the SMILES notation for 2-(dimethoxymethyl)pyrazine?
The canonical SMILES for 2-(dimethoxymethyl)pyrazine is COC(OC)c1cnccn1.
What is the InChIKey of 2-(dimethoxymethyl)pyrazine?
The InChIKey is NIBJCESTFHTYHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2/c1-10-7(11-2)6-5-8-3-4-9-6/h3-5,7H,1-2H3.
What are the key properties of 2-(dimethoxymethyl)pyrazine?
2-(dimethoxymethyl)pyrazine has a molecular weight of 154.17 g/mol, XLogP of 0.77, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethoxymethyl)pyrazine is sourced from PubChem (CID 91367678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).