ethane;1,3,6-trimethyl-2H-pyrazine

C9H18N2 — CID 143336614

IUPACethane;1,3,6-trimethyl-2H-pyrazine
SMILESCC.CC1=CN=C(C)CN1C
InChIInChI=1S/C7H12N2.C2H6/c1-6-5-9(3)7(2)4-8-6;1-2/h4H,5H2,1-3H3;1-2H3
InChIKeyMHVOIXKNMPFWMR-UHFFFAOYSA-N
MW154.26 g/mol
LogP2.28
Rot. Bonds

About ethane;1,3,6-trimethyl-2H-pyrazine

ethane;1,3,6-trimethyl-2H-pyrazine (PubChem CID 143336614) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is ethane;1,3,6-trimethyl-2H-pyrazine.

Molecular Properties

Compound Nameethane;1,3,6-trimethyl-2H-pyrazine
PubChem CID143336614
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Nameethane;1,3,6-trimethyl-2H-pyrazine
SMILESCC.CC1=CN=C(C)CN1C
InChIInChI=1S/C7H12N2.C2H6/c1-6-5-9(3)7(2)4-8-6;1-2/h4H,5H2,1-3H3;1-2H3
InChIKeyMHVOIXKNMPFWMR-UHFFFAOYSA-N
XLogP2.28
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,3,5-Trimethyl-1,2-dihydropyrazine
CID 45087193
2,4,5-Trimethylpyrazine
CID 89439351
[2-(Diethylamino)cycloprop-2-en-1-ylidene]-diethylazanium
CID 102340527
N,N'-diethyl-2,5-dimethylpyrazinium fluoroborate
CID 129716916
1,2,3,6-tetramethyl-2H-pyrazine
CID 67745664
1,2,3,5-tetramethyl-2H-pyrazine
CID 70381448
1,6-dimethyl-3-propan-2-yl-2H-pyrazine
CID 70454200
2,3,5-trimethyl-1-prop-1-enyl-2H-pyrazine
CID 86055709
N-(2-piperidin-1-ylprop-1-enyl)propan-2-imine
CID 91104453
3-ethyl-1,1,6-trimethyl-2H-pyrazin-1-ium
CID 91163840
N,N-dimethyl-2-[(Z)-prop-1-enyl]iminopropan-1-amine
CID 118370069
6-ethyl-1,1-dimethyl-2H-pyrazin-1-ium
CID 121452111

Frequently Asked Questions

What is the IUPAC name of ethane;1,3,6-trimethyl-2H-pyrazine?
The IUPAC name of ethane;1,3,6-trimethyl-2H-pyrazine (CID 143336614) is ethane;1,3,6-trimethyl-2H-pyrazine.
What is the SMILES notation for ethane;1,3,6-trimethyl-2H-pyrazine?
The canonical SMILES for ethane;1,3,6-trimethyl-2H-pyrazine is CC.CC1=CN=C(C)CN1C.
What is the InChIKey of ethane;1,3,6-trimethyl-2H-pyrazine?
The InChIKey is MHVOIXKNMPFWMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2.C2H6/c1-6-5-9(3)7(2)4-8-6;1-2/h4H,5H2,1-3H3;1-2H3.
What are the key properties of ethane;1,3,6-trimethyl-2H-pyrazine?
ethane;1,3,6-trimethyl-2H-pyrazine has a molecular weight of 154.26 g/mol, XLogP of 2.28, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1,3,6-trimethyl-2H-pyrazine is sourced from PubChem (CID 143336614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).