4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine

C12H19N3O — CID 58278892

IUPAC4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine
SMILESCC(C)c1cncc(CN2CCOCC2)n1
InChIInChI=1S/C12H19N3O/c1-10(2)12-8-13-7-11(14-12)9-15-3-5-16-6-4-15/h7-8,10H,3-6,9H2,1-2H3
InChIKeyVQRYJBSDVQFBNM-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.43
Rot. Bonds3

About 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine

4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine (PubChem CID 58278892) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine
PubChem CID58278892
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine
SMILESCC(C)c1cncc(CN2CCOCC2)n1
InChIInChI=1S/C12H19N3O/c1-10(2)12-8-13-7-11(14-12)9-15-3-5-16-6-4-15/h7-8,10H,3-6,9H2,1-2H3
InChIKeyVQRYJBSDVQFBNM-UHFFFAOYSA-N
XLogP1.43
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine?
The IUPAC name of 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine (CID 58278892) is 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine.
What is the SMILES notation for 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine?
The canonical SMILES for 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine is CC(C)c1cncc(CN2CCOCC2)n1.
What is the InChIKey of 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine?
The InChIKey is VQRYJBSDVQFBNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-10(2)12-8-13-7-11(14-12)9-15-3-5-16-6-4-15/h7-8,10H,3-6,9H2,1-2H3.
What are the key properties of 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine?
4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine has a molecular weight of 221.30 g/mol, XLogP of 1.43, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-propan-2-ylpyrazin-2-yl)methyl]morpholine is sourced from PubChem (CID 58278892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).