4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine

C15H19N3O2S — CID 133491544

IUPAC4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine
SMILESCC(C)Oc1cncc(N2CCOC(c3cccs3)C2)n1
InChIInChI=1S/C15H19N3O2S/c1-11(2)20-15-9-16-8-14(17-15)18-5-6-19-12(10-18)13-4-3-7-21-13/h3-4,7-9,11-12H,5-6,10H2,1-2H3
InChIKeyMJKGROOJHQCQIL-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.90
Rot. Bonds4

About 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine

4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine (PubChem CID 133491544) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine.

Molecular Properties

Compound Name4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine
PubChem CID133491544
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine
SMILESCC(C)Oc1cncc(N2CCOC(c3cccs3)C2)n1
InChIInChI=1S/C15H19N3O2S/c1-11(2)20-15-9-16-8-14(17-15)18-5-6-19-12(10-18)13-4-3-7-21-13/h3-4,7-9,11-12H,5-6,10H2,1-2H3
InChIKeyMJKGROOJHQCQIL-UHFFFAOYSA-N
XLogP2.90
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine?
The IUPAC name of 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine (CID 133491544) is 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine.
What is the SMILES notation for 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine?
The canonical SMILES for 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine is CC(C)Oc1cncc(N2CCOC(c3cccs3)C2)n1.
What is the InChIKey of 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine?
The InChIKey is MJKGROOJHQCQIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-11(2)20-15-9-16-8-14(17-15)18-5-6-19-12(10-18)13-4-3-7-21-13/h3-4,7-9,11-12H,5-6,10H2,1-2H3.
What are the key properties of 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine?
4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine has a molecular weight of 305.40 g/mol, XLogP of 2.90, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-propan-2-yloxypyrazin-2-yl)-2-thiophen-2-ylmorpholine is sourced from PubChem (CID 133491544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).