6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine

C13H22N4 — CID 78917909

IUPAC6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine
SMILESCCNc1cncc(NC2CCCCC2C)n1
InChIInChI=1S/C13H22N4/c1-3-15-12-8-14-9-13(17-12)16-11-7-5-4-6-10(11)2/h8-11H,3-7H2,1-2H3,(H2,15,16,17)
InChIKeyBLJPHMINEVGORE-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.90
Rot. Bonds4

About 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine

6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine (PubChem CID 78917909) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine
PubChem CID78917909
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine
SMILESCCNc1cncc(NC2CCCCC2C)n1
InChIInChI=1S/C13H22N4/c1-3-15-12-8-14-9-13(17-12)16-11-7-5-4-6-10(11)2/h8-11H,3-7H2,1-2H3,(H2,15,16,17)
InChIKeyBLJPHMINEVGORE-UHFFFAOYSA-N
XLogP2.90
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine?
The IUPAC name of 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine (CID 78917909) is 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine.
What is the SMILES notation for 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine?
The canonical SMILES for 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine is CCNc1cncc(NC2CCCCC2C)n1.
What is the InChIKey of 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine?
The InChIKey is BLJPHMINEVGORE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-3-15-12-8-14-9-13(17-12)16-11-7-5-4-6-10(11)2/h8-11H,3-7H2,1-2H3,(H2,15,16,17).
What are the key properties of 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine?
6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine has a molecular weight of 234.35 g/mol, XLogP of 2.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-2-N-(2-methylcyclohexyl)pyrazine-2,6-diamine is sourced from PubChem (CID 78917909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).