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

C8H12N2OS — CID 130916889

IUPAC3-methyl-4-(1,3-thiazol-2-yl)morpholine
SMILESCC1COCCN1c1nccs1
InChIInChI=1S/C8H12N2OS/c1-7-6-11-4-3-10(7)8-9-2-5-12-8/h2,5,7H,3-4,6H2,1H3
InChIKeyANACGXRWLRPILK-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.37
Rot. Bonds1

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

3-methyl-4-(1,3-thiazol-2-yl)morpholine (PubChem CID 130916889) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 3-methyl-4-(1,3-thiazol-2-yl)morpholine.

Molecular Properties

Compound Name3-methyl-4-(1,3-thiazol-2-yl)morpholine
PubChem CID130916889
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name3-methyl-4-(1,3-thiazol-2-yl)morpholine
SMILESCC1COCCN1c1nccs1
InChIInChI=1S/C8H12N2OS/c1-7-6-11-4-3-10(7)8-9-2-5-12-8/h2,5,7H,3-4,6H2,1H3
InChIKeyANACGXRWLRPILK-UHFFFAOYSA-N
XLogP1.37
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 ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-methyl-4-(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

Related Compounds

N-[(4-methylmorpholin-2-yl)methyl]-1,3-thiazol-2-amine
CID 73994620
2-Oxo-2-(1,3-thiazol-2-ylamino)ethyl 4-morpholinecarbodithioate
CID 900890
1-Ethyl-9-(1,3-thiazol-2-yl)-4-oxa-1,9-diazaspiro[5.5]undecane
CID 97396257
4-(1,3-Thiazol-2-yl)morpholine
CID 15475837
Methyl [4-(1,3-thiazol-2-yl)piperazin-1-yl]acetate
CID 28880817
(E)-1-morpholin-4-yl-N-(1,3-thiazol-2-yl)methanimine
CID 9660703
4-(5-Bromo-1,3-thiazol-2-yl)morpholine
CID 45787551
Tris(2-hydroxyethyl)-(1,3-thiazol-2-yl)azanium
CID 123791014
2-[4-[2-(2,2,2-Trifluoroethoxy)ethyl]piperazin-1-yl]-1,3-thiazole
CID 53530005
2-[4-[3-(2,2,2-Trifluoroethoxy)propyl]piperazin-1-yl]-1,3-thiazole
CID 86829416
1-[(3R,4S)-4-fluorooxolan-3-yl]-4-(1,3-thiazol-2-yl)piperazine
CID 126856291
N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine
CID 126857875

Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(1,3-thiazol-2-yl)morpholine?
The IUPAC name of 3-methyl-4-(1,3-thiazol-2-yl)morpholine (CID 130916889) is 3-methyl-4-(1,3-thiazol-2-yl)morpholine.
What is the SMILES notation for 3-methyl-4-(1,3-thiazol-2-yl)morpholine?
The canonical SMILES for 3-methyl-4-(1,3-thiazol-2-yl)morpholine is CC1COCCN1c1nccs1.
What is the InChIKey of 3-methyl-4-(1,3-thiazol-2-yl)morpholine?
The InChIKey is ANACGXRWLRPILK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c1-7-6-11-4-3-10(7)8-9-2-5-12-8/h2,5,7H,3-4,6H2,1H3.
What are the key properties of 3-methyl-4-(1,3-thiazol-2-yl)morpholine?
3-methyl-4-(1,3-thiazol-2-yl)morpholine has a molecular weight of 184.26 g/mol, XLogP of 1.37, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(1,3-thiazol-2-yl)morpholine is sourced from PubChem (CID 130916889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).