3-(3-hydroxypropyl)-1,3-thiazolidin-4-one

C6H11NO2S — CID 11955010

IUPAC3-(3-hydroxypropyl)-1,3-thiazolidin-4-one
SMILESO=C1CSCN1CCCO
InChIInChI=1S/C6H11NO2S/c8-3-1-2-7-5-10-4-6(7)9/h8H,1-5H2
InChIKeyCKWMKVZLSYDNKE-UHFFFAOYSA-N
MW161.23 g/mol
LogP-0.10
Rot. Bonds3

About 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one

3-(3-hydroxypropyl)-1,3-thiazolidin-4-one (PubChem CID 11955010) has the molecular formula C6H11NO2S and a molecular weight of 161.23 g/mol. Its IUPAC name is 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one.

Molecular Properties

Compound Name3-(3-hydroxypropyl)-1,3-thiazolidin-4-one
PubChem CID11955010
Molecular FormulaC6H11NO2S
Molecular Weight161.23 g/mol
Exact Mass161.05
IUPAC Name3-(3-hydroxypropyl)-1,3-thiazolidin-4-one
SMILESO=C1CSCN1CCCO
InChIInChI=1S/C6H11NO2S/c8-3-1-2-7-5-10-4-6(7)9/h8H,1-5H2
InChIKeyCKWMKVZLSYDNKE-UHFFFAOYSA-N
XLogP-0.10
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.23
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3-Hydroxypropyl)-2-sulfanylidene-1,3-thiazolidin-4-one
CID 122707196
4-Thiazolidinone, 3-(2-hydroxyethyl)-
CID 3685883
N-(3-hydroxy-1-oxoprop-1-yl)thiazolidinethione
CID 169502306
1-[2-(Hydroxymethyl)-1,3-thiazolidin-3-yl]propan-1-one
CID 20648598
Bis(2-hydroxyethyl)-(2-oxo-2-pyrrolidin-1-ylethyl)sulfanium
CID 23535087
3-(3-Hydroxypropyl)-1,3-thiazolidine-2,4-dione
CID 43509836
3-(3-Methoxy-n-propyl)-2,4-thiazolidinedione
CID 86183559
3-Hydroxy-1-(1-oxo-1,3-thiazolidin-3-yl)propan-1-one
CID 89126551
3-(3-Hydroxy-2,2-dimethylpropyl)-1,3-thiazolidin-2-one
CID 141264152
3-Ethyl-4-hydroxy-1,3-thiazolidin-2-one
CID 153222709
3-(4-Hydroxybutyl)-1,3-thiazolidin-2-one
CID 174299794
3-(1-Hydroxybutan-2-yl)-1,3-thiazolidin-4-one
CID 10997560

Frequently Asked Questions

What is the IUPAC name of 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one?
The IUPAC name of 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one (CID 11955010) is 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one.
What is the SMILES notation for 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one?
The canonical SMILES for 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one is O=C1CSCN1CCCO.
What is the InChIKey of 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one?
The InChIKey is CKWMKVZLSYDNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2S/c8-3-1-2-7-5-10-4-6(7)9/h8H,1-5H2.
What are the key properties of 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one?
3-(3-hydroxypropyl)-1,3-thiazolidin-4-one has a molecular weight of 161.23 g/mol, XLogP of -0.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-hydroxypropyl)-1,3-thiazolidin-4-one is sourced from PubChem (CID 11955010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).