ethane;2,3,5-trimethyl-1,2-dihydropyrazine

C11H24N2 — CID 171629306

IUPACethane;2,3,5-trimethyl-1,2-dihydropyrazine
SMILESCC.CC.CC1=CNC(C)C(C)=N1
InChIInChI=1S/C7H12N2.2C2H6/c1-5-4-8-6(2)7(3)9-5;2*1-2/h4,6,8H,1-3H3;2*1-2H3
InChIKeyGCEFYOOAQVSGQT-UHFFFAOYSA-N
MW184.33 g/mol
LogP3.35
Rot. Bonds

About ethane;2,3,5-trimethyl-1,2-dihydropyrazine

ethane;2,3,5-trimethyl-1,2-dihydropyrazine (PubChem CID 171629306) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is ethane;2,3,5-trimethyl-1,2-dihydropyrazine.

Molecular Properties

Compound Nameethane;2,3,5-trimethyl-1,2-dihydropyrazine
PubChem CID171629306
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Nameethane;2,3,5-trimethyl-1,2-dihydropyrazine
SMILESCC.CC.CC1=CNC(C)C(C)=N1
InChIInChI=1S/C7H12N2.2C2H6/c1-5-4-8-6(2)7(3)9-5;2*1-2/h4,6,8H,1-3H3;2*1-2H3
InChIKeyGCEFYOOAQVSGQT-UHFFFAOYSA-N
XLogP3.35
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-Dimethyldihydropyrazine
CID 19926417
2-Ethyl-3,5-dimethyl-1,2-dihydropyrazine
CID 17861464
2-Ethyl-5-methyl-1,2-dihydropyrazine
CID 20691937
2,5-Diethyl-1,2-dihydropyrazine
CID 23385894
N-[(1,5-dimethyl-2H-pyrazin-2-yl)methyl]ethanamine
CID 67337870
2,3-Dimethyl-1,2-dihydropyrazine
CID 68479354
3,5-Dimethyl-1,2-dihydropyrazine
CID 88985928
3,6-Dimethyl-1,2-dihydropyrazine
CID 88986983
(Z)-N-methyl-1-(propan-2-ylideneamino)prop-1-en-2-amine
CID 89138569
N-[(Z)-2-(propan-2-ylideneamino)ethenyl]prop-1-en-2-amine
CID 89152929
(6-Methyl-1,2-dihydropyrazin-3-yl)methanamine
CID 89185799
(Z)-2-(butan-2-ylideneamino)-N-methylprop-1-en-1-amine
CID 117957547

Frequently Asked Questions

What is the IUPAC name of ethane;2,3,5-trimethyl-1,2-dihydropyrazine?
The IUPAC name of ethane;2,3,5-trimethyl-1,2-dihydropyrazine (CID 171629306) is ethane;2,3,5-trimethyl-1,2-dihydropyrazine.
What is the SMILES notation for ethane;2,3,5-trimethyl-1,2-dihydropyrazine?
The canonical SMILES for ethane;2,3,5-trimethyl-1,2-dihydropyrazine is CC.CC.CC1=CNC(C)C(C)=N1.
What is the InChIKey of ethane;2,3,5-trimethyl-1,2-dihydropyrazine?
The InChIKey is GCEFYOOAQVSGQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2.2C2H6/c1-5-4-8-6(2)7(3)9-5;2*1-2/h4,6,8H,1-3H3;2*1-2H3.
What are the key properties of ethane;2,3,5-trimethyl-1,2-dihydropyrazine?
ethane;2,3,5-trimethyl-1,2-dihydropyrazine has a molecular weight of 184.33 g/mol, XLogP of 3.35, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2,3,5-trimethyl-1,2-dihydropyrazine is sourced from PubChem (CID 171629306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).