5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine

C9H18N2 — CID 129275845

IUPAC5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine
SMILESCCC1=C(C)N(C)CCN1C
InChIInChI=1S/C9H18N2/c1-5-9-8(2)10(3)6-7-11(9)4/h5-7H2,1-4H3
InChIKeyYMHFRGXOVLNYAL-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.51
Rot. Bonds1

About 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine

5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine (PubChem CID 129275845) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine.

Molecular Properties

Compound Name5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine
PubChem CID129275845
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine
SMILESCCC1=C(C)N(C)CCN1C
InChIInChI=1S/C9H18N2/c1-5-9-8(2)10(3)6-7-11(9)4/h5-7H2,1-4H3
InChIKeyYMHFRGXOVLNYAL-UHFFFAOYSA-N
XLogP1.51
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine?
The IUPAC name of 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine (CID 129275845) is 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine.
What is the SMILES notation for 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine?
The canonical SMILES for 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine is CCC1=C(C)N(C)CCN1C.
What is the InChIKey of 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine?
The InChIKey is YMHFRGXOVLNYAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-5-9-8(2)10(3)6-7-11(9)4/h5-7H2,1-4H3.
What are the key properties of 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine?
5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine has a molecular weight of 154.26 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1,4,6-trimethyl-2,3-dihydropyrazine is sourced from PubChem (CID 129275845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).