4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one

C6H10N2O2S — CID 90935715

IUPAC4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one
SMILESCNCCn1c(O)csc1=O
InChIInChI=1S/C6H10N2O2S/c1-7-2-3-8-5(9)4-11-6(8)10/h4,7,9H,2-3H2,1H3
InChIKeyUGXXZUPJJFFZMJ-UHFFFAOYSA-N
MW174.23 g/mol
LogP-0.17
Rot. Bonds3

About 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one

4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one (PubChem CID 90935715) has the molecular formula C6H10N2O2S and a molecular weight of 174.23 g/mol. Its IUPAC name is 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one.

Molecular Properties

Compound Name4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one
PubChem CID90935715
Molecular FormulaC6H10N2O2S
Molecular Weight174.23 g/mol
Exact Mass174.05
IUPAC Name4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one
SMILESCNCCn1c(O)csc1=O
InChIInChI=1S/C6H10N2O2S/c1-7-2-3-8-5(9)4-11-6(8)10/h4,7,9H,2-3H2,1H3
InChIKeyUGXXZUPJJFFZMJ-UHFFFAOYSA-N
XLogP-0.17
TPSA54.26 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.23
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-(2-Aminoethyl)-4-hydroxy-1,3-thiazol-2-one
CID 54477865
3-[2-(Dimethylamino)ethyl]-4-hydroxy-1,3-thiazol-2-one
CID 123700873
3-[2-(Ethylamino)ethyl]-1,3-thiazol-2-one
CID 63312549
3-[2-(Methylamino)ethyl]-1,3-thiazol-2-one
CID 63312602

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one?
The IUPAC name of 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one (CID 90935715) is 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one.
What is the SMILES notation for 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one?
The canonical SMILES for 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one is CNCCn1c(O)csc1=O.
What is the InChIKey of 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one?
The InChIKey is UGXXZUPJJFFZMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2S/c1-7-2-3-8-5(9)4-11-6(8)10/h4,7,9H,2-3H2,1H3.
What are the key properties of 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one?
4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one has a molecular weight of 174.23 g/mol, XLogP of -0.17, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-[2-(methylamino)ethyl]-1,3-thiazol-2-one is sourced from PubChem (CID 90935715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).