5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile

C13H16N4O2 — CID 133491078

IUPAC5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile
SMILESN#Cc1cnc(N2CCOC(C3CCCO3)C2)cn1
InChIInChI=1S/C13H16N4O2/c14-6-10-7-16-13(8-15-10)17-3-5-19-12(9-17)11-2-1-4-18-11/h7-8,11-12H,1-5,9H2
InChIKeyWOZOWODLCVQFQH-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.73
Rot. Bonds2

About 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile

5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile (PubChem CID 133491078) has the molecular formula C13H16N4O2 and a molecular weight of 260.30 g/mol. Its IUPAC name is 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile
PubChem CID133491078
Molecular FormulaC13H16N4O2
Molecular Weight260.30 g/mol
Exact Mass260.13
IUPAC Name5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile
SMILESN#Cc1cnc(N2CCOC(C3CCCO3)C2)cn1
InChIInChI=1S/C13H16N4O2/c14-6-10-7-16-13(8-15-10)17-3-5-19-12(9-17)11-2-1-4-18-11/h7-8,11-12H,1-5,9H2
InChIKeyWOZOWODLCVQFQH-UHFFFAOYSA-N
XLogP0.73
TPSA71.27 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile?
The IUPAC name of 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile (CID 133491078) is 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile.
What is the SMILES notation for 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile?
The canonical SMILES for 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile is N#Cc1cnc(N2CCOC(C3CCCO3)C2)cn1.
What is the InChIKey of 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile?
The InChIKey is WOZOWODLCVQFQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N4O2/c14-6-10-7-16-13(8-15-10)17-3-5-19-12(9-17)11-2-1-4-18-11/h7-8,11-12H,1-5,9H2.
What are the key properties of 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile?
5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile has a molecular weight of 260.30 g/mol, XLogP of 0.73, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(oxolan-2-yl)morpholin-4-yl]pyrazine-2-carbonitrile is sourced from PubChem (CID 133491078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).