3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine

C14H25N3 — CID 22278727

IUPAC3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine
SMILESCCc1cnc(CC)c(NCC(CC)CC)n1
InChIInChI=1S/C14H25N3/c1-5-11(6-2)9-16-14-13(8-4)15-10-12(7-3)17-14/h10-11H,5-9H2,1-4H3,(H,16,17)
InChIKeyDVBXKADGSAVIGK-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.45
Rot. Bonds7

About 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine

3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine (PubChem CID 22278727) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine.

Molecular Properties

Compound Name3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine
PubChem CID22278727
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine
SMILESCCc1cnc(CC)c(NCC(CC)CC)n1
InChIInChI=1S/C14H25N3/c1-5-11(6-2)9-16-14-13(8-4)15-10-12(7-3)17-14/h10-11H,5-9H2,1-4H3,(H,16,17)
InChIKeyDVBXKADGSAVIGK-UHFFFAOYSA-N
XLogP3.45
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine?
The IUPAC name of 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine (CID 22278727) is 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine.
What is the SMILES notation for 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine?
The canonical SMILES for 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine is CCc1cnc(CC)c(NCC(CC)CC)n1.
What is the InChIKey of 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine?
The InChIKey is DVBXKADGSAVIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-5-11(6-2)9-16-14-13(8-4)15-10-12(7-3)17-14/h10-11H,5-9H2,1-4H3,(H,16,17).
What are the key properties of 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine?
3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine has a molecular weight of 235.37 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-diethyl-N-(2-ethylbutyl)pyrazin-2-amine is sourced from PubChem (CID 22278727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).