4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine

C7H10N4 — CID 142610455

IUPAC4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine
SMILES[H]/N=C(\C)N1C=CNC(=C)/C1=N\[H]
InChIInChI=1S/C7H10N4/c1-5-7(9)11(6(2)8)4-3-10-5/h3-4,8-10H,1H2,2H3/b8-6+,9-7+
InChIKeyUZDFWQUBAWDWGV-CDJQDVQCSA-N
MW150.18 g/mol
LogP0.85
Rot. Bonds

About 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine

4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine (PubChem CID 142610455) has the molecular formula C7H10N4 and a molecular weight of 150.18 g/mol. Its IUPAC name is 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine.

Molecular Properties

Compound Name4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine
PubChem CID142610455
Molecular FormulaC7H10N4
Molecular Weight150.18 g/mol
Exact Mass150.09
IUPAC Name4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine
SMILES[H]/N=C(\C)N1C=CNC(=C)/C1=N\[H]
InChIInChI=1S/C7H10N4/c1-5-7(9)11(6(2)8)4-3-10-5/h3-4,8-10H,1H2,2H3/b8-6+,9-7+
InChIKeyUZDFWQUBAWDWGV-CDJQDVQCSA-N
XLogP0.85
TPSA62.97 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.85
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

(Z)-3-imino-N-methyl-3-(4-methylpiperazin-1-yl)prop-1-en-1-amine
CID 142094873
ethane;4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine
CID 142610454
2-methylidene-4-(2-methylpropanimidoyl)-1H-pyrazin-3-imine
CID 142610555
4-Ethyl-1,2-dihydropyrazin-3-imine
CID 170025251
N,N-dimethyl-2-methylidene-1H-pyrazin-3-amine
CID 171531972
(6-imino-1,3-dimethyl-2H-pyrazin-5-ylidene)methanamine
CID 145668127

Frequently Asked Questions

What is the IUPAC name of 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine?
The IUPAC name of 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine (CID 142610455) is 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine.
What is the SMILES notation for 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine?
The canonical SMILES for 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine is [H]/N=C(\C)N1C=CNC(=C)/C1=N\[H].
What is the InChIKey of 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine?
The InChIKey is UZDFWQUBAWDWGV-CDJQDVQCSA-N. The full InChI is InChI=1S/C7H10N4/c1-5-7(9)11(6(2)8)4-3-10-5/h3-4,8-10H,1H2,2H3/b8-6+,9-7+.
What are the key properties of 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine?
4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine has a molecular weight of 150.18 g/mol, XLogP of 0.85, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethanimidoyl-2-methylidene-1H-pyrazin-3-imine is sourced from PubChem (CID 142610455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).