N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine

C11H17N3O2 — CID 80860142

IUPACN-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine
SMILESCCNc1cncc(OCC2CCCO2)n1
InChIInChI=1S/C11H17N3O2/c1-2-13-10-6-12-7-11(14-10)16-8-9-4-3-5-15-9/h6-7,9H,2-5,8H2,1H3,(H,13,14)
InChIKeyIQHSMONBCCADNT-UHFFFAOYSA-N
MW223.28 g/mol
LogP1.47
Rot. Bonds5

About N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine

N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine (PubChem CID 80860142) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine.

Molecular Properties

Compound NameN-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine
PubChem CID80860142
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC NameN-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine
SMILESCCNc1cncc(OCC2CCCO2)n1
InChIInChI=1S/C11H17N3O2/c1-2-13-10-6-12-7-11(14-10)16-8-9-4-3-5-15-9/h6-7,9H,2-5,8H2,1H3,(H,13,14)
InChIKeyIQHSMONBCCADNT-UHFFFAOYSA-N
XLogP1.47
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine?
The IUPAC name of N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine (CID 80860142) is N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine.
What is the SMILES notation for N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine?
The canonical SMILES for N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine is CCNc1cncc(OCC2CCCO2)n1.
What is the InChIKey of N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine?
The InChIKey is IQHSMONBCCADNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-2-13-10-6-12-7-11(14-10)16-8-9-4-3-5-15-9/h6-7,9H,2-5,8H2,1H3,(H,13,14).
What are the key properties of N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine?
N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine has a molecular weight of 223.28 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-(oxolan-2-ylmethoxy)pyrazin-2-amine is sourced from PubChem (CID 80860142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).