2-(1,3-thiazolidin-3-yl)propan-2-ol

C6H13NOS — CID 142000311

IUPAC2-(1,3-thiazolidin-3-yl)propan-2-ol
SMILESCC(C)(O)N1CCSC1
InChIInChI=1S/C6H13NOS/c1-6(2,8)7-3-4-9-5-7/h8H,3-5H2,1-2H3
InChIKeyLGDPMLCARMCQIM-UHFFFAOYSA-N
MW147.24 g/mol
LogP0.72
Rot. Bonds1

About 2-(1,3-thiazolidin-3-yl)propan-2-ol

2-(1,3-thiazolidin-3-yl)propan-2-ol (PubChem CID 142000311) has the molecular formula C6H13NOS and a molecular weight of 147.24 g/mol. Its IUPAC name is 2-(1,3-thiazolidin-3-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1,3-thiazolidin-3-yl)propan-2-ol
PubChem CID142000311
Molecular FormulaC6H13NOS
Molecular Weight147.24 g/mol
Exact Mass147.07
IUPAC Name2-(1,3-thiazolidin-3-yl)propan-2-ol
SMILESCC(C)(O)N1CCSC1
InChIInChI=1S/C6H13NOS/c1-6(2,8)7-3-4-9-5-7/h8H,3-5H2,1-2H3
InChIKeyLGDPMLCARMCQIM-UHFFFAOYSA-N
XLogP0.72
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.24
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ethane;2-(1,3-thiazolidin-3-yl)propan-2-ol
CID 142000310
3-Ethyl-4-hydroxy-4-methyl-1,3-thiazolidin-2-one
CID 163756222
(1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol
CID 163989388
4-Hydroxy-4-methyl-3-propan-2-yl-1,3-thiazolidine-2-thione
CID 21816035
4-Hydroxy-3,4-dimethyl-1,3-thiazolidine-2-thione
CID 119096840

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazolidin-3-yl)propan-2-ol?
The IUPAC name of 2-(1,3-thiazolidin-3-yl)propan-2-ol (CID 142000311) is 2-(1,3-thiazolidin-3-yl)propan-2-ol.
What is the SMILES notation for 2-(1,3-thiazolidin-3-yl)propan-2-ol?
The canonical SMILES for 2-(1,3-thiazolidin-3-yl)propan-2-ol is CC(C)(O)N1CCSC1.
What is the InChIKey of 2-(1,3-thiazolidin-3-yl)propan-2-ol?
The InChIKey is LGDPMLCARMCQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NOS/c1-6(2,8)7-3-4-9-5-7/h8H,3-5H2,1-2H3.
What are the key properties of 2-(1,3-thiazolidin-3-yl)propan-2-ol?
2-(1,3-thiazolidin-3-yl)propan-2-ol has a molecular weight of 147.24 g/mol, XLogP of 0.72, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazolidin-3-yl)propan-2-ol is sourced from PubChem (CID 142000311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).