2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone

C12H18N2O3S — CID 131650772

IUPAC2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone
SMILESCCOCC(=O)N1CCOCC1c1csc(C)n1
InChIInChI=1S/C12H18N2O3S/c1-3-16-7-12(15)14-4-5-17-6-11(14)10-8-18-9(2)13-10/h8,11H,3-7H2,1-2H3
InChIKeyJZXJLZUMGIDRKN-UHFFFAOYSA-N
MW270.35 g/mol
LogP1.39
Rot. Bonds4

About 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone

2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone (PubChem CID 131650772) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone
PubChem CID131650772
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone
SMILESCCOCC(=O)N1CCOCC1c1csc(C)n1
InChIInChI=1S/C12H18N2O3S/c1-3-16-7-12(15)14-4-5-17-6-11(14)10-8-18-9(2)13-10/h8,11H,3-7H2,1-2H3
InChIKeyJZXJLZUMGIDRKN-UHFFFAOYSA-N
XLogP1.39
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone?
The IUPAC name of 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone (CID 131650772) is 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone.
What is the SMILES notation for 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone?
The canonical SMILES for 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone is CCOCC(=O)N1CCOCC1c1csc(C)n1.
What is the InChIKey of 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone?
The InChIKey is JZXJLZUMGIDRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-3-16-7-12(15)14-4-5-17-6-11(14)10-8-18-9(2)13-10/h8,11H,3-7H2,1-2H3.
What are the key properties of 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone?
2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone has a molecular weight of 270.35 g/mol, XLogP of 1.39, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-[3-(2-methyl-1,3-thiazol-4-yl)morpholin-4-yl]ethanone is sourced from PubChem (CID 131650772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).