6-(2-ethylphenoxy)-N-propylpyrazin-2-amine

C15H19N3O — CID 80875740

IUPAC6-(2-ethylphenoxy)-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(Oc2ccccc2CC)n1
InChIInChI=1S/C15H19N3O/c1-3-9-17-14-10-16-11-15(18-14)19-13-8-6-5-7-12(13)4-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,18)
InChIKeyWHBJPQOPVYGHML-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.65
Rot. Bonds6

About 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine

6-(2-ethylphenoxy)-N-propylpyrazin-2-amine (PubChem CID 80875740) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine.

Molecular Properties

Compound Name6-(2-ethylphenoxy)-N-propylpyrazin-2-amine
PubChem CID80875740
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name6-(2-ethylphenoxy)-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(Oc2ccccc2CC)n1
InChIInChI=1S/C15H19N3O/c1-3-9-17-14-10-16-11-15(18-14)19-13-8-6-5-7-12(13)4-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,18)
InChIKeyWHBJPQOPVYGHML-UHFFFAOYSA-N
XLogP3.65
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine?
The IUPAC name of 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine (CID 80875740) is 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine.
What is the SMILES notation for 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine?
The canonical SMILES for 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine is CCCNc1cncc(Oc2ccccc2CC)n1.
What is the InChIKey of 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine?
The InChIKey is WHBJPQOPVYGHML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-3-9-17-14-10-16-11-15(18-14)19-13-8-6-5-7-12(13)4-2/h5-8,10-11H,3-4,9H2,1-2H3,(H,17,18).
What are the key properties of 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine?
6-(2-ethylphenoxy)-N-propylpyrazin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 3.65, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethylphenoxy)-N-propylpyrazin-2-amine is sourced from PubChem (CID 80875740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).