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

C6H13NOS — CID 129215935

IUPAC1-(1,3-thiazolidin-3-yl)propan-2-ol
SMILESCC(O)CN1CCSC1
InChIInChI=1S/C6H13NOS/c1-6(8)4-7-2-3-9-5-7/h6,8H,2-5H2,1H3
InChIKeyGDIQRWGXQVYUTQ-UHFFFAOYSA-N
MW147.24 g/mol
LogP0.37
Rot. Bonds2

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

1-(1,3-thiazolidin-3-yl)propan-2-ol (PubChem CID 129215935) has the molecular formula C6H13NOS and a molecular weight of 147.24 g/mol. Its IUPAC name is 1-(1,3-thiazolidin-3-yl)propan-2-ol.

Molecular Properties

Compound Name1-(1,3-thiazolidin-3-yl)propan-2-ol
PubChem CID129215935
Molecular FormulaC6H13NOS
Molecular Weight147.24 g/mol
Exact Mass147.07
IUPAC Name1-(1,3-thiazolidin-3-yl)propan-2-ol
SMILESCC(O)CN1CCSC1
InChIInChI=1S/C6H13NOS/c1-6(8)4-7-2-3-9-5-7/h6,8H,2-5H2,1H3
InChIKeyGDIQRWGXQVYUTQ-UHFFFAOYSA-N
XLogP0.37
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.24
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-thiazolidin-3-yl)propan-2-ol?
The IUPAC name of 1-(1,3-thiazolidin-3-yl)propan-2-ol (CID 129215935) is 1-(1,3-thiazolidin-3-yl)propan-2-ol.
What is the SMILES notation for 1-(1,3-thiazolidin-3-yl)propan-2-ol?
The canonical SMILES for 1-(1,3-thiazolidin-3-yl)propan-2-ol is CC(O)CN1CCSC1.
What is the InChIKey of 1-(1,3-thiazolidin-3-yl)propan-2-ol?
The InChIKey is GDIQRWGXQVYUTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NOS/c1-6(8)4-7-2-3-9-5-7/h6,8H,2-5H2,1H3.
What are the key properties of 1-(1,3-thiazolidin-3-yl)propan-2-ol?
1-(1,3-thiazolidin-3-yl)propan-2-ol has a molecular weight of 147.24 g/mol, XLogP of 0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-thiazolidin-3-yl)propan-2-ol is sourced from PubChem (CID 129215935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).