4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one

C9H14N2O2S — CID 64534656

IUPAC4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one
SMILESCc1csc(=O)n1CC1CNCCO1
InChIInChI=1S/C9H14N2O2S/c1-7-6-14-9(12)11(7)5-8-4-10-2-3-13-8/h6,8,10H,2-5H2,1H3
InChIKeyFXLRPXFLCHQHOH-UHFFFAOYSA-N
MW214.29 g/mol
LogP0.21
Rot. Bonds2

About 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one

4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one (PubChem CID 64534656) has the molecular formula C9H14N2O2S and a molecular weight of 214.29 g/mol. Its IUPAC name is 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one.

Molecular Properties

Compound Name4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one
PubChem CID64534656
Molecular FormulaC9H14N2O2S
Molecular Weight214.29 g/mol
Exact Mass214.08
IUPAC Name4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one
SMILESCc1csc(=O)n1CC1CNCCO1
InChIInChI=1S/C9H14N2O2S/c1-7-6-14-9(12)11(7)5-8-4-10-2-3-13-8/h6,8,10H,2-5H2,1H3
InChIKeyFXLRPXFLCHQHOH-UHFFFAOYSA-N
XLogP0.21
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.29
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one?
The IUPAC name of 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one (CID 64534656) is 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one.
What is the SMILES notation for 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one?
The canonical SMILES for 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one is Cc1csc(=O)n1CC1CNCCO1.
What is the InChIKey of 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one?
The InChIKey is FXLRPXFLCHQHOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2S/c1-7-6-14-9(12)11(7)5-8-4-10-2-3-13-8/h6,8,10H,2-5H2,1H3.
What are the key properties of 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one?
4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one has a molecular weight of 214.29 g/mol, XLogP of 0.21, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(morpholin-2-ylmethyl)-1,3-thiazol-2-one is sourced from PubChem (CID 64534656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).