2-butyl-6-ethylpyrazine

C10H16N2 — CID 91862985

IUPAC2-butyl-6-ethylpyrazine
SMILESCCCCc1cncc(CC)n1
InChIInChI=1S/C10H16N2/c1-3-5-6-10-8-11-7-9(4-2)12-10/h7-8H,3-6H2,1-2H3
InChIKeySWXKPVFHMXCWTM-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.38
Rot. Bonds4

About 2-butyl-6-ethylpyrazine

2-butyl-6-ethylpyrazine (PubChem CID 91862985) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 2-butyl-6-ethylpyrazine.

Molecular Properties

Compound Name2-butyl-6-ethylpyrazine
PubChem CID91862985
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name2-butyl-6-ethylpyrazine
SMILESCCCCc1cncc(CC)n1
InChIInChI=1S/C10H16N2/c1-3-5-6-10-8-11-7-9(4-2)12-10/h7-8H,3-6H2,1-2H3
InChIKeySWXKPVFHMXCWTM-UHFFFAOYSA-N
XLogP2.38
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-6-propylpyrazine
CID 54541556
6-butylpyrazin-2-amine
CID 89087055
2-nonan-5-yl-6-pentylpyrazine
CID 518702
2,6-dibutyl-N,N-dimethylpyridin-4-amine
CID 151473916
(6-butyl-2-pyridinyl)methanamine
CID 67813294
4-butyl-2,6-di(docosyl)pyridine
CID 91143668
2,6-dipentylpyridine
CID 58097448
3,4,5-tributylpyridine
CID 173010708
(1S,2R,3S,4R)-1-(6-pentylpyrazin-2-yl)pentane-1,2,3,4,5-pentol
CID 57092020
2,6-didodecylpyridine
CID 90943274
2-butyl-1,6-naphthyridine
CID 23383449
2,3-dimethyl-5-undecylpyrazine
CID 57349452

Frequently Asked Questions

What is the IUPAC name of 2-butyl-6-ethylpyrazine?
The IUPAC name of 2-butyl-6-ethylpyrazine (CID 91862985) is 2-butyl-6-ethylpyrazine.
What is the SMILES notation for 2-butyl-6-ethylpyrazine?
The canonical SMILES for 2-butyl-6-ethylpyrazine is CCCCc1cncc(CC)n1.
What is the InChIKey of 2-butyl-6-ethylpyrazine?
The InChIKey is SWXKPVFHMXCWTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-3-5-6-10-8-11-7-9(4-2)12-10/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-butyl-6-ethylpyrazine?
2-butyl-6-ethylpyrazine has a molecular weight of 164.25 g/mol, XLogP of 2.38, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-6-ethylpyrazine is sourced from PubChem (CID 91862985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).