1-methyl-4-prop-2-enyl-2,3-dihydropyrazine

C8H14N2 — CID 148954691

IUPAC1-methyl-4-prop-2-enyl-2,3-dihydropyrazine
SMILESC=CCN1C=CN(C)CC1
InChIInChI=1S/C8H14N2/c1-3-4-10-7-5-9(2)6-8-10/h3,5,7H,1,4,6,8H2,2H3
InChIKeyPQPSDJFRPZIRDT-UHFFFAOYSA-N
MW138.21 g/mol
LogP0.89
Rot. Bonds2

About 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine

1-methyl-4-prop-2-enyl-2,3-dihydropyrazine (PubChem CID 148954691) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine.

Molecular Properties

Compound Name1-methyl-4-prop-2-enyl-2,3-dihydropyrazine
PubChem CID148954691
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name1-methyl-4-prop-2-enyl-2,3-dihydropyrazine
SMILESC=CCN1C=CN(C)CC1
InChIInChI=1S/C8H14N2/c1-3-4-10-7-5-9(2)6-8-10/h3,5,7H,1,4,6,8H2,2H3
InChIKeyPQPSDJFRPZIRDT-UHFFFAOYSA-N
XLogP0.89
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 50.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine?
The IUPAC name of 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine (CID 148954691) is 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine.
What is the SMILES notation for 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine?
The canonical SMILES for 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine is C=CCN1C=CN(C)CC1.
What is the InChIKey of 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine?
The InChIKey is PQPSDJFRPZIRDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-3-4-10-7-5-9(2)6-8-10/h3,5,7H,1,4,6,8H2,2H3.
What are the key properties of 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine?
1-methyl-4-prop-2-enyl-2,3-dihydropyrazine has a molecular weight of 138.21 g/mol, XLogP of 0.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-prop-2-enyl-2,3-dihydropyrazine is sourced from PubChem (CID 148954691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).