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

C9H14N2OS — CID 76675563

IUPAC3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine
SMILESCc1csc(N2CCOCC2C)n1
InChIInChI=1S/C9H14N2OS/c1-7-6-13-9(10-7)11-3-4-12-5-8(11)2/h6,8H,3-5H2,1-2H3
InChIKeyOCSHDOSTKBDKTE-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.68
Rot. Bonds1

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

3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine (PubChem CID 76675563) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine.

Molecular Properties

Compound Name3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine
PubChem CID76675563
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine
SMILESCc1csc(N2CCOCC2C)n1
InChIInChI=1S/C9H14N2OS/c1-7-6-13-9(10-7)11-3-4-12-5-8(11)2/h6,8H,3-5H2,1-2H3
InChIKeyOCSHDOSTKBDKTE-UHFFFAOYSA-N
XLogP1.68
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine 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-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine?
The IUPAC name of 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine (CID 76675563) is 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine.
What is the SMILES notation for 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine?
The canonical SMILES for 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine is Cc1csc(N2CCOCC2C)n1.
What is the InChIKey of 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine?
The InChIKey is OCSHDOSTKBDKTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-7-6-13-9(10-7)11-3-4-12-5-8(11)2/h6,8H,3-5H2,1-2H3.
What are the key properties of 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine?
3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine has a molecular weight of 198.29 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(4-methyl-1,3-thiazol-2-yl)morpholine is sourced from PubChem (CID 76675563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).