4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one

C9H14N2O2S — CID 130009479

IUPAC4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one
SMILESO=c1[nH]c(CCN2CCOCC2)cs1
InChIInChI=1S/C9H14N2O2S/c12-9-10-8(7-14-9)1-2-11-3-5-13-6-4-11/h7H,1-6H2,(H,10,12)
InChIKeyYLSZWPBDCIEPMW-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.31
Rot. Bonds3

About 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one

4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one (PubChem CID 130009479) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one.

Molecular Properties

Compound Name4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one
PubChem CID130009479
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC Name4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one
SMILESO=c1[nH]c(CCN2CCOCC2)cs1
InChIInChI=1S/C9H14N2O2S/c12-9-10-8(7-14-9)1-2-11-3-5-13-6-4-11/h7H,1-6H2,(H,10,12)
InChIKeyYLSZWPBDCIEPMW-UHFFFAOYSA-N
XLogP0.31
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one?
The IUPAC name of 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one (CID 130009479) is 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one.
What is the SMILES notation for 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one?
The canonical SMILES for 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one is O=c1[nH]c(CCN2CCOCC2)cs1.
What is the InChIKey of 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one?
The InChIKey is YLSZWPBDCIEPMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c12-9-10-8(7-14-9)1-2-11-3-5-13-6-4-11/h7H,1-6H2,(H,10,12).
What are the key properties of 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one?
4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one has a molecular weight of 214.29 g/mol, XLogP of 0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-morpholin-4-ylethyl)-3H-1,3-thiazol-2-one is sourced from PubChem (CID 130009479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).