4-(2-ethyl-1,3-thiazol-5-yl)morpholine

C9H14N2OS — CID 89317794

IUPAC4-(2-ethyl-1,3-thiazol-5-yl)morpholine
SMILESCCc1ncc(N2CCOCC2)s1
InChIInChI=1S/C9H14N2OS/c1-2-8-10-7-9(13-8)11-3-5-12-6-4-11/h7H,2-6H2,1H3
InChIKeyAFDBLHZBCIOJGJ-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.54
Rot. Bonds2

About 4-(2-ethyl-1,3-thiazol-5-yl)morpholine

4-(2-ethyl-1,3-thiazol-5-yl)morpholine (PubChem CID 89317794) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 4-(2-ethyl-1,3-thiazol-5-yl)morpholine.

Molecular Properties

Compound Name4-(2-ethyl-1,3-thiazol-5-yl)morpholine
PubChem CID89317794
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name4-(2-ethyl-1,3-thiazol-5-yl)morpholine
SMILESCCc1ncc(N2CCOCC2)s1
InChIInChI=1S/C9H14N2OS/c1-2-8-10-7-9(13-8)11-3-5-12-6-4-11/h7H,2-6H2,1H3
InChIKeyAFDBLHZBCIOJGJ-UHFFFAOYSA-N
XLogP1.54
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-ethyl-1,3-thiazol-5-yl)morpholine?
The IUPAC name of 4-(2-ethyl-1,3-thiazol-5-yl)morpholine (CID 89317794) is 4-(2-ethyl-1,3-thiazol-5-yl)morpholine.
What is the SMILES notation for 4-(2-ethyl-1,3-thiazol-5-yl)morpholine?
The canonical SMILES for 4-(2-ethyl-1,3-thiazol-5-yl)morpholine is CCc1ncc(N2CCOCC2)s1.
What is the InChIKey of 4-(2-ethyl-1,3-thiazol-5-yl)morpholine?
The InChIKey is AFDBLHZBCIOJGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-2-8-10-7-9(13-8)11-3-5-12-6-4-11/h7H,2-6H2,1H3.
What are the key properties of 4-(2-ethyl-1,3-thiazol-5-yl)morpholine?
4-(2-ethyl-1,3-thiazol-5-yl)morpholine has a molecular weight of 198.29 g/mol, XLogP of 1.54, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethyl-1,3-thiazol-5-yl)morpholine is sourced from PubChem (CID 89317794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).