1,2,3,4,5,6-hexaethylpyrazine

C16H30N2 — CID 69493814

IUPAC1,2,3,4,5,6-hexaethylpyrazine
SMILESCCC1=C(CC)N(CC)C(CC)=C(CC)N1CC
InChIInChI=1S/C16H30N2/c1-7-13-14(8-2)18(12-6)16(10-4)15(9-3)17(13)11-5/h7-12H2,1-6H3
InChIKeyQXUPTGKEWVGLDF-UHFFFAOYSA-N
MW250.43 g/mol
LogP4.71
Rot. Bonds6

About 1,2,3,4,5,6-hexaethylpyrazine

1,2,3,4,5,6-hexaethylpyrazine (PubChem CID 69493814) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 1,2,3,4,5,6-hexaethylpyrazine.

Molecular Properties

Compound Name1,2,3,4,5,6-hexaethylpyrazine
PubChem CID69493814
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name1,2,3,4,5,6-hexaethylpyrazine
SMILESCCC1=C(CC)N(CC)C(CC)=C(CC)N1CC
InChIInChI=1S/C16H30N2/c1-7-13-14(8-2)18(12-6)16(10-4)15(9-3)17(13)11-5/h7-12H2,1-6H3
InChIKeyQXUPTGKEWVGLDF-UHFFFAOYSA-N
XLogP4.71
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-N,3-N,4-N,4-N-tetramethylhex-3-ene-3,4-diamine
CID 53888278
1,3,5-Triethyl-2,4,6-trimethyl-1,4-azaborinine
CID 57250393
1,4-Dimethyl-5,6-di(propan-2-yl)-2,3-dihydropyrazine
CID 90075872
N-ethyl-2-methyl-N-propylpent-2-en-3-amine
CID 91512977
5-Ethyl-1,4-dimethyl-6-propan-2-yl-2,3-dihydropyrazine
CID 129275780
5-Ethyl-1,4,6-trimethyl-2,3-dihydropyrazine
CID 129275845
(E)-N-ethyl-N,4-dimethylhex-3-en-3-amine;methane
CID 141779254
(E)-N-ethyl-N,4-dimethylhex-3-en-3-amine;propane
CID 142411665
1,4,5-Trimethyl-6-propan-2-yl-2,3-dihydropyrazine
CID 146512931
N,N-diethyl-2-methylpent-2-en-3-amine
CID 159866404
5,6-Ditert-butyl-1,4-dimethyl-2,3-dihydropyrazine;ethane
CID 160667679
1,2,3-Trimethyl-4,5,6-tri(propan-2-yl)pyrazine
CID 170037448

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,6-hexaethylpyrazine?
The IUPAC name of 1,2,3,4,5,6-hexaethylpyrazine (CID 69493814) is 1,2,3,4,5,6-hexaethylpyrazine.
What is the SMILES notation for 1,2,3,4,5,6-hexaethylpyrazine?
The canonical SMILES for 1,2,3,4,5,6-hexaethylpyrazine is CCC1=C(CC)N(CC)C(CC)=C(CC)N1CC.
What is the InChIKey of 1,2,3,4,5,6-hexaethylpyrazine?
The InChIKey is QXUPTGKEWVGLDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-7-13-14(8-2)18(12-6)16(10-4)15(9-3)17(13)11-5/h7-12H2,1-6H3.
What are the key properties of 1,2,3,4,5,6-hexaethylpyrazine?
1,2,3,4,5,6-hexaethylpyrazine has a molecular weight of 250.43 g/mol, XLogP of 4.71, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,6-hexaethylpyrazine is sourced from PubChem (CID 69493814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).