2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine

C9H14N2 — CID 135336273

IUPAC2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine
SMILESC/C=C\C1(C)NC=CN=C1C
InChIInChI=1S/C9H14N2/c1-4-5-9(3)8(2)10-6-7-11-9/h4-7,11H,1-3H3/b5-4-
InChIKeyXDQZLAZHJJSBHM-PLNGDYQASA-N
MW150.22 g/mol
LogP1.86
Rot. Bonds1

About 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine

2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine (PubChem CID 135336273) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine.

Molecular Properties

Compound Name2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine
PubChem CID135336273
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine
SMILESC/C=C\C1(C)NC=CN=C1C
InChIInChI=1S/C9H14N2/c1-4-5-9(3)8(2)10-6-7-11-9/h4-7,11H,1-3H3/b5-4-
InChIKeyXDQZLAZHJJSBHM-PLNGDYQASA-N
XLogP1.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.86
H-Bond Donors ≤ 51
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 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine?
The IUPAC name of 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine (CID 135336273) is 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine.
What is the SMILES notation for 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine?
The canonical SMILES for 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine is C/C=C\C1(C)NC=CN=C1C.
What is the InChIKey of 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine?
The InChIKey is XDQZLAZHJJSBHM-PLNGDYQASA-N. The full InChI is InChI=1S/C9H14N2/c1-4-5-9(3)8(2)10-6-7-11-9/h4-7,11H,1-3H3/b5-4-.
What are the key properties of 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine?
2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine has a molecular weight of 150.22 g/mol, XLogP of 1.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-2-[(Z)-prop-1-enyl]-1H-pyrazine is sourced from PubChem (CID 135336273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).