6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine

C11H18N4O — CID 80648161

IUPAC6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine
SMILESCN1CCCC1CCOc1cncc(N)n1
InChIInChI=1S/C11H18N4O/c1-15-5-2-3-9(15)4-6-16-11-8-13-7-10(12)14-11/h7-9H,2-6H2,1H3,(H2,12,14)
InChIKeyXXDBJDHMAPWUIK-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.92
Rot. Bonds4

About 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine

6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine (PubChem CID 80648161) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine.

Molecular Properties

Compound Name6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine
PubChem CID80648161
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine
SMILESCN1CCCC1CCOc1cncc(N)n1
InChIInChI=1S/C11H18N4O/c1-15-5-2-3-9(15)4-6-16-11-8-13-7-10(12)14-11/h7-9H,2-6H2,1H3,(H2,12,14)
InChIKeyXXDBJDHMAPWUIK-UHFFFAOYSA-N
XLogP0.92
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine?
The IUPAC name of 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine (CID 80648161) is 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine.
What is the SMILES notation for 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine?
The canonical SMILES for 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine is CN1CCCC1CCOc1cncc(N)n1.
What is the InChIKey of 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine?
The InChIKey is XXDBJDHMAPWUIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-15-5-2-3-9(15)4-6-16-11-8-13-7-10(12)14-11/h7-9H,2-6H2,1H3,(H2,12,14).
What are the key properties of 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine?
6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine has a molecular weight of 222.29 g/mol, XLogP of 0.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(1-methylpyrrolidin-2-yl)ethoxy]pyrazin-2-amine is sourced from PubChem (CID 80648161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).