(2S)-2-methyl-1,3-thiazolidine

C4H9NS — CID 641522

IUPAC(2S)-2-methyl-1,3-thiazolidine
SMILESC[C@H]1NCCS1
InChIInChI=1S/C4H9NS/c1-4-5-2-3-6-4/h4-5H,2-3H2,1H3/t4-/m0/s1
InChIKeyDQMLFUMEBNHPPB-BYPYZUCNSA-N
MW103.19 g/mol
LogP0.67
Rot. Bonds

About (2S)-2-methyl-1,3-thiazolidine

(2S)-2-methyl-1,3-thiazolidine (PubChem CID 641522) has the molecular formula C4H9NS and a molecular weight of 103.19 g/mol. Its IUPAC name is (2S)-2-methyl-1,3-thiazolidine.

Molecular Properties

Compound Name(2S)-2-methyl-1,3-thiazolidine
PubChem CID641522
Molecular FormulaC4H9NS
Molecular Weight103.19 g/mol
Exact Mass103.05
IUPAC Name(2S)-2-methyl-1,3-thiazolidine
SMILESC[C@H]1NCCS1
InChIInChI=1S/C4H9NS/c1-4-5-2-3-6-4/h4-5H,2-3H2,1H3/t4-/m0/s1
InChIKeyDQMLFUMEBNHPPB-BYPYZUCNSA-N
XLogP0.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.19
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-1,3-thiazolidine?
The IUPAC name of (2S)-2-methyl-1,3-thiazolidine (CID 641522) is (2S)-2-methyl-1,3-thiazolidine.
What is the SMILES notation for (2S)-2-methyl-1,3-thiazolidine?
The canonical SMILES for (2S)-2-methyl-1,3-thiazolidine is C[C@H]1NCCS1.
What is the InChIKey of (2S)-2-methyl-1,3-thiazolidine?
The InChIKey is DQMLFUMEBNHPPB-BYPYZUCNSA-N. The full InChI is InChI=1S/C4H9NS/c1-4-5-2-3-6-4/h4-5H,2-3H2,1H3/t4-/m0/s1.
What are the key properties of (2S)-2-methyl-1,3-thiazolidine?
(2S)-2-methyl-1,3-thiazolidine has a molecular weight of 103.19 g/mol, XLogP of 0.67, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-1,3-thiazolidine is sourced from PubChem (CID 641522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).