(1,1-dioxo-1,2-thiazolidin-2-yl)methanol

C4H9NO3S — CID 130129909

IUPAC(1,1-dioxo-1,2-thiazolidin-2-yl)methanol
SMILESO=S1(=O)CCCN1CO
InChIInChI=1S/C4H9NO3S/c6-4-5-2-1-3-9(5,7)8/h6H,1-4H2
InChIKeyQMGQGELZKZYBPQ-UHFFFAOYSA-N
MW151.19 g/mol
LogP-1.03
Rot. Bonds1

About (1,1-dioxo-1,2-thiazolidin-2-yl)methanol

(1,1-dioxo-1,2-thiazolidin-2-yl)methanol (PubChem CID 130129909) has the molecular formula C4H9NO3S and a molecular weight of 151.19 g/mol. Its IUPAC name is (1,1-dioxo-1,2-thiazolidin-2-yl)methanol.

Molecular Properties

Compound Name(1,1-dioxo-1,2-thiazolidin-2-yl)methanol
PubChem CID130129909
Molecular FormulaC4H9NO3S
Molecular Weight151.19 g/mol
Exact Mass151.03
IUPAC Name(1,1-dioxo-1,2-thiazolidin-2-yl)methanol
SMILESO=S1(=O)CCCN1CO
InChIInChI=1S/C4H9NO3S/c6-4-5-2-1-3-9(5,7)8/h6H,1-4H2
InChIKeyQMGQGELZKZYBPQ-UHFFFAOYSA-N
XLogP-1.03
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.19
LogP ≤ 5-1.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1,1-dioxo-1,2-thiazolidin-2-yl)pentan-1-ol
CID 62228047
[2-[(1,1-dioxo-1,2-thiazolidin-2-yl)methyl]cyclohexyl]methanol
CID 104550224
4-(1,1-dioxo-1,2-thiazolidin-2-yl)-3,3-dimethylbutan-1-ol
CID 106145959
1-chloro-3-(1,1-dioxo-1,2-thiazolidin-2-yl)propan-2-ol
CID 112560169
2-(1,1-dioxo-1,2-thiazolidin-2-yl)acetohydrazide
CID 14668524
1-(1,1-dioxo-1,2-thiazolidin-2-yl)butan-2-ol
CID 115584238
4-(1,1-dioxo-1,2-thiazolidin-2-yl)-2-methylbutan-2-ol
CID 79361203
5-(1,1-dioxo-1,2-thiazolidin-2-yl)-4,4-dimethylpentan-1-ol
CID 106146168
6-(1,1-dioxo-1,2-thiazolidin-2-yl)hexan-2-one
CID 62025074
3-(1,1-dioxothiazinan-2-yl)-2,2-dimethylpropan-1-ol
CID 116816741
2-(4-chlorobut-2-enyl)-1,2-thiazolidine 1,1-dioxide
CID 77051539
2-[(1,1-dioxothiazinan-2-yl)methyl]-2-ethylbutan-1-ol
CID 106253912

Frequently Asked Questions

What is the IUPAC name of (1,1-dioxo-1,2-thiazolidin-2-yl)methanol?
The IUPAC name of (1,1-dioxo-1,2-thiazolidin-2-yl)methanol (CID 130129909) is (1,1-dioxo-1,2-thiazolidin-2-yl)methanol.
What is the SMILES notation for (1,1-dioxo-1,2-thiazolidin-2-yl)methanol?
The canonical SMILES for (1,1-dioxo-1,2-thiazolidin-2-yl)methanol is O=S1(=O)CCCN1CO.
What is the InChIKey of (1,1-dioxo-1,2-thiazolidin-2-yl)methanol?
The InChIKey is QMGQGELZKZYBPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO3S/c6-4-5-2-1-3-9(5,7)8/h6H,1-4H2.
What are the key properties of (1,1-dioxo-1,2-thiazolidin-2-yl)methanol?
(1,1-dioxo-1,2-thiazolidin-2-yl)methanol has a molecular weight of 151.19 g/mol, XLogP of -1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,1-dioxo-1,2-thiazolidin-2-yl)methanol is sourced from PubChem (CID 130129909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).