2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine

C13H21N3O2 — CID 102634526

IUPAC2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine
SMILESCCOc1cncc(OC2CCCCC2NC)n1
InChIInChI=1S/C13H21N3O2/c1-3-17-12-8-15-9-13(16-12)18-11-7-5-4-6-10(11)14-2/h8-11,14H,3-7H2,1-2H3
InChIKeyRAFFDQDBINGMDI-UHFFFAOYSA-N
MW251.33 g/mol
LogP1.78
Rot. Bonds5

About 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine

2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine (PubChem CID 102634526) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine.

Molecular Properties

Compound Name2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine
PubChem CID102634526
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine
SMILESCCOc1cncc(OC2CCCCC2NC)n1
InChIInChI=1S/C13H21N3O2/c1-3-17-12-8-15-9-13(16-12)18-11-7-5-4-6-10(11)14-2/h8-11,14H,3-7H2,1-2H3
InChIKeyRAFFDQDBINGMDI-UHFFFAOYSA-N
XLogP1.78
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine?
The IUPAC name of 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine (CID 102634526) is 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine.
What is the SMILES notation for 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine?
The canonical SMILES for 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine is CCOc1cncc(OC2CCCCC2NC)n1.
What is the InChIKey of 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine?
The InChIKey is RAFFDQDBINGMDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-3-17-12-8-15-9-13(16-12)18-11-7-5-4-6-10(11)14-2/h8-11,14H,3-7H2,1-2H3.
What are the key properties of 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine?
2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine has a molecular weight of 251.33 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethoxypyrazin-2-yl)oxy-N-methylcyclohexan-1-amine is sourced from PubChem (CID 102634526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).