6-ethyl-N-pentan-3-ylpyrazin-2-amine

C11H19N3 — CID 23068434

IUPAC6-ethyl-N-pentan-3-ylpyrazin-2-amine
SMILESCCc1cncc(NC(CC)CC)n1
InChIInChI=1S/C11H19N3/c1-4-9(5-2)13-11-8-12-7-10(6-3)14-11/h7-9H,4-6H2,1-3H3,(H,13,14)
InChIKeyOKJCRARIXUFFGG-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.64
Rot. Bonds5

About 6-ethyl-N-pentan-3-ylpyrazin-2-amine

6-ethyl-N-pentan-3-ylpyrazin-2-amine (PubChem CID 23068434) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 6-ethyl-N-pentan-3-ylpyrazin-2-amine.

Molecular Properties

Compound Name6-ethyl-N-pentan-3-ylpyrazin-2-amine
PubChem CID23068434
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name6-ethyl-N-pentan-3-ylpyrazin-2-amine
SMILESCCc1cncc(NC(CC)CC)n1
InChIInChI=1S/C11H19N3/c1-4-9(5-2)13-11-8-12-7-10(6-3)14-11/h7-9H,4-6H2,1-3H3,(H,13,14)
InChIKeyOKJCRARIXUFFGG-UHFFFAOYSA-N
XLogP2.64
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-pentan-3-ylpyrazin-2-amine?
The IUPAC name of 6-ethyl-N-pentan-3-ylpyrazin-2-amine (CID 23068434) is 6-ethyl-N-pentan-3-ylpyrazin-2-amine.
What is the SMILES notation for 6-ethyl-N-pentan-3-ylpyrazin-2-amine?
The canonical SMILES for 6-ethyl-N-pentan-3-ylpyrazin-2-amine is CCc1cncc(NC(CC)CC)n1.
What is the InChIKey of 6-ethyl-N-pentan-3-ylpyrazin-2-amine?
The InChIKey is OKJCRARIXUFFGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-4-9(5-2)13-11-8-12-7-10(6-3)14-11/h7-9H,4-6H2,1-3H3,(H,13,14).
What are the key properties of 6-ethyl-N-pentan-3-ylpyrazin-2-amine?
6-ethyl-N-pentan-3-ylpyrazin-2-amine has a molecular weight of 193.29 g/mol, XLogP of 2.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-pentan-3-ylpyrazin-2-amine is sourced from PubChem (CID 23068434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).