3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile

C11H14N4O2 — CID 71996195

IUPAC3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile
SMILESCOCC1CN(c2nccnc2C#N)CCO1
InChIInChI=1S/C11H14N4O2/c1-16-8-9-7-15(4-5-17-9)11-10(6-12)13-2-3-14-11/h2-3,9H,4-5,7-8H2,1H3
InChIKeyFAFGUPCGAIQLDY-UHFFFAOYSA-N
MW234.26 g/mol
LogP0.20
Rot. Bonds3

About 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile

3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile (PubChem CID 71996195) has the molecular formula C11H14N4O2 and a molecular weight of 234.26 g/mol. Its IUPAC name is 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile
PubChem CID71996195
Molecular FormulaC11H14N4O2
Molecular Weight234.26 g/mol
Exact Mass234.11
IUPAC Name3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile
SMILESCOCC1CN(c2nccnc2C#N)CCO1
InChIInChI=1S/C11H14N4O2/c1-16-8-9-7-15(4-5-17-9)11-10(6-12)13-2-3-14-11/h2-3,9H,4-5,7-8H2,1H3
InChIKeyFAFGUPCGAIQLDY-UHFFFAOYSA-N
XLogP0.20
TPSA71.27 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 50.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile 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 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile?
The IUPAC name of 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile (CID 71996195) is 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile.
What is the SMILES notation for 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile?
The canonical SMILES for 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile is COCC1CN(c2nccnc2C#N)CCO1.
What is the InChIKey of 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile?
The InChIKey is FAFGUPCGAIQLDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2/c1-16-8-9-7-15(4-5-17-9)11-10(6-12)13-2-3-14-11/h2-3,9H,4-5,7-8H2,1H3.
What are the key properties of 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile?
3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile has a molecular weight of 234.26 g/mol, XLogP of 0.20, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(methoxymethyl)morpholin-4-yl]pyrazine-2-carbonitrile is sourced from PubChem (CID 71996195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).