(1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol

C6H13NOS — CID 163989388

IUPAC(1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol
SMILESC[C@H](O)N1CS[C@@H](C)C1
InChIInChI=1S/C6H13NOS/c1-5-3-7(4-9-5)6(2)8/h5-6,8H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKeyTZGHHRPKBILWJD-WDSKDSINSA-N
MW147.24 g/mol
LogP0.72
Rot. Bonds1

About (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol

(1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol (PubChem CID 163989388) has the molecular formula C6H13NOS and a molecular weight of 147.24 g/mol. Its IUPAC name is (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol.

Molecular Properties

Compound Name(1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol
PubChem CID163989388
Molecular FormulaC6H13NOS
Molecular Weight147.24 g/mol
Exact Mass147.07
IUPAC Name(1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol
SMILESC[C@H](O)N1CS[C@@H](C)C1
InChIInChI=1S/C6H13NOS/c1-5-3-7(4-9-5)6(2)8/h5-6,8H,3-4H2,1-2H3/t5-,6-/m0/s1
InChIKeyTZGHHRPKBILWJD-WDSKDSINSA-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

3-Thiazolidineethanol
CID 13743632
1-[2-(Hydroxymethyl)-1,3-thiazolidin-3-yl]propane-1-thione
CID 20648599
(5-Methyl-1,3-thiazolidin-3-yl)methanol
CID 20691963
(3-Methyl-1,3-thiazolidin-2-yl)methanol
CID 20699545
3-(3-Hydroxypropyl)-1,3-thiazolidine-2-thione
CID 21324770
2-(2-Pyrrolidin-1-ylethylsulfanyl)ethanol
CID 43393655
3-(1,3-Thiazolidin-3-yl)propan-1-ol
CID 45088138
2-Hydroxyethyl pyrrolidine-1-carbodithioate
CID 71677633
3-(1-Hydroxypropyl)-1,3-thiazolidine-2-thione
CID 88738214
3-(1-Hydroxyethyl)-1,3-thiazolidine-2-thione
CID 88741845
1-(1,3-Thiazolidin-3-yl)ethanol
CID 89013400
[(2S)-3-methyl-1,3-thiazolidin-2-yl]methanol
CID 90054199

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol?
The IUPAC name of (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol (CID 163989388) is (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol.
What is the SMILES notation for (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol?
The canonical SMILES for (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol is C[C@H](O)N1CS[C@@H](C)C1.
What is the InChIKey of (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol?
The InChIKey is TZGHHRPKBILWJD-WDSKDSINSA-N. The full InChI is InChI=1S/C6H13NOS/c1-5-3-7(4-9-5)6(2)8/h5-6,8H,3-4H2,1-2H3/t5-,6-/m0/s1.
What are the key properties of (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol?
(1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol 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 (1S)-1-[(5S)-5-methyl-1,3-thiazolidin-3-yl]ethanol is sourced from PubChem (CID 163989388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).