2-propoxypyrazine

C7H10N2O — CID 23273416

IUPAC2-propoxypyrazine
SMILESCCCOc1cnccn1
InChIInChI=1S/C7H10N2O/c1-2-5-10-7-6-8-3-4-9-7/h3-4,6H,2,5H2,1H3
InChIKeyGNMZGUJLGRPVMC-UHFFFAOYSA-N
MW138.17 g/mol
LogP1.27
Rot. Bonds3

About 2-propoxypyrazine

2-propoxypyrazine (PubChem CID 23273416) has the molecular formula C7H10N2O and a molecular weight of 138.17 g/mol. Its IUPAC name is 2-propoxypyrazine.

Molecular Properties

Compound Name2-propoxypyrazine
PubChem CID23273416
Molecular FormulaC7H10N2O
Molecular Weight138.17 g/mol
Exact Mass138.08
IUPAC Name2-propoxypyrazine
SMILESCCCOc1cnccn1
InChIInChI=1S/C7H10N2O/c1-2-5-10-7-6-8-3-4-9-7/h3-4,6H,2,5H2,1H3
InChIKeyGNMZGUJLGRPVMC-UHFFFAOYSA-N
XLogP1.27
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.17
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-propoxypyrazine?
The IUPAC name of 2-propoxypyrazine (CID 23273416) is 2-propoxypyrazine.
What is the SMILES notation for 2-propoxypyrazine?
The canonical SMILES for 2-propoxypyrazine is CCCOc1cnccn1.
What is the InChIKey of 2-propoxypyrazine?
The InChIKey is GNMZGUJLGRPVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O/c1-2-5-10-7-6-8-3-4-9-7/h3-4,6H,2,5H2,1H3.
What are the key properties of 2-propoxypyrazine?
2-propoxypyrazine has a molecular weight of 138.17 g/mol, XLogP of 1.27, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propoxypyrazine is sourced from PubChem (CID 23273416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).