1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine

C12H18N2 — CID 165143533

IUPAC1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine
SMILESC=C1C=NC=CN1/C(=C\C(C)C)CC
InChIInChI=1S/C12H18N2/c1-5-12(8-10(2)3)14-7-6-13-9-11(14)4/h6-10H,4-5H2,1-3H3/b12-8-
InChIKeyVVDGNRJPJAYCOT-WQLSENKSSA-N
MW190.29 g/mol
LogP3.31
Rot. Bonds3

About 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine

1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine (PubChem CID 165143533) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine.

Molecular Properties

Compound Name1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine
PubChem CID165143533
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine
SMILESC=C1C=NC=CN1/C(=C\C(C)C)CC
InChIInChI=1S/C12H18N2/c1-5-12(8-10(2)3)14-7-6-13-9-11(14)4/h6-10H,4-5H2,1-3H3/b12-8-
InChIKeyVVDGNRJPJAYCOT-WQLSENKSSA-N
XLogP3.31
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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N-ethenyl-N-methyl-1-(2-methylprop-2-enylideneamino)hepta-1,5-dien-2-amine
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(2E)-2-butylidene-1-[(Z)-prop-1-enyl]pyrazine
CID 139437241
(Z)-N,N,4-trimethyl-1-methyliminopent-2-en-3-amine
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ethane;(2Z)-1-ethenyl-2-ethylidene-3,6-dimethylpyrazine;methane
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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine?
The IUPAC name of 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine (CID 165143533) is 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine.
What is the SMILES notation for 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine?
The canonical SMILES for 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine is C=C1C=NC=CN1/C(=C\C(C)C)CC.
What is the InChIKey of 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine?
The InChIKey is VVDGNRJPJAYCOT-WQLSENKSSA-N. The full InChI is InChI=1S/C12H18N2/c1-5-12(8-10(2)3)14-7-6-13-9-11(14)4/h6-10H,4-5H2,1-3H3/b12-8-.
What are the key properties of 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine?
1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine has a molecular weight of 190.29 g/mol, XLogP of 3.31, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-5-methylhex-3-en-3-yl]-2-methylidenepyrazine is sourced from PubChem (CID 165143533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).