4-methyl-3-(1,3-thiazol-2-yl)morpholine

C8H12N2OS — CID 131131451

IUPAC4-methyl-3-(1,3-thiazol-2-yl)morpholine
SMILESCN1CCOCC1c1nccs1
InChIInChI=1S/C8H12N2OS/c1-10-3-4-11-6-7(10)8-9-2-5-12-8/h2,5,7H,3-4,6H2,1H3
InChIKeyGGSLTTLDWYJJRF-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.15
Rot. Bonds1

About 4-methyl-3-(1,3-thiazol-2-yl)morpholine

4-methyl-3-(1,3-thiazol-2-yl)morpholine (PubChem CID 131131451) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 4-methyl-3-(1,3-thiazol-2-yl)morpholine.

Molecular Properties

Compound Name4-methyl-3-(1,3-thiazol-2-yl)morpholine
PubChem CID131131451
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name4-methyl-3-(1,3-thiazol-2-yl)morpholine
SMILESCN1CCOCC1c1nccs1
InChIInChI=1S/C8H12N2OS/c1-10-3-4-11-6-7(10)8-9-2-5-12-8/h2,5,7H,3-4,6H2,1H3
InChIKeyGGSLTTLDWYJJRF-UHFFFAOYSA-N
XLogP1.15
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(1,3-thiazol-2-yl)morpholine?
The IUPAC name of 4-methyl-3-(1,3-thiazol-2-yl)morpholine (CID 131131451) is 4-methyl-3-(1,3-thiazol-2-yl)morpholine.
What is the SMILES notation for 4-methyl-3-(1,3-thiazol-2-yl)morpholine?
The canonical SMILES for 4-methyl-3-(1,3-thiazol-2-yl)morpholine is CN1CCOCC1c1nccs1.
What is the InChIKey of 4-methyl-3-(1,3-thiazol-2-yl)morpholine?
The InChIKey is GGSLTTLDWYJJRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-10-3-4-11-6-7(10)8-9-2-5-12-8/h2,5,7H,3-4,6H2,1H3.
What are the key properties of 4-methyl-3-(1,3-thiazol-2-yl)morpholine?
4-methyl-3-(1,3-thiazol-2-yl)morpholine has a molecular weight of 184.26 g/mol, XLogP of 1.15, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(1,3-thiazol-2-yl)morpholine is sourced from PubChem (CID 131131451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).