(4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine

C6H11NS — CID 155070776

IUPAC(4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine
SMILESC=C1SCN(C)[C@@H]1C
InChIInChI=1S/C6H11NS/c1-5-6(2)8-4-7(5)3/h5H,2,4H2,1,3H3/t5-/m1/s1
InChIKeyKNUQOYOVGLFGKU-RXMQYKEDSA-N
MW129.23 g/mol
LogP1.52
Rot. Bonds

About (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine

(4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine (PubChem CID 155070776) has the molecular formula C6H11NS and a molecular weight of 129.23 g/mol. Its IUPAC name is (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine.

Molecular Properties

Compound Name(4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine
PubChem CID155070776
Molecular FormulaC6H11NS
Molecular Weight129.23 g/mol
Exact Mass129.06
IUPAC Name(4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine
SMILESC=C1SCN(C)[C@@H]1C
InChIInChI=1S/C6H11NS/c1-5-6(2)8-4-7(5)3/h5H,2,4H2,1,3H3/t5-/m1/s1
InChIKeyKNUQOYOVGLFGKU-RXMQYKEDSA-N
XLogP1.52
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.23
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine?
The IUPAC name of (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine (CID 155070776) is (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine.
What is the SMILES notation for (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine?
The canonical SMILES for (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine is C=C1SCN(C)[C@@H]1C.
What is the InChIKey of (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine?
The InChIKey is KNUQOYOVGLFGKU-RXMQYKEDSA-N. The full InChI is InChI=1S/C6H11NS/c1-5-6(2)8-4-7(5)3/h5H,2,4H2,1,3H3/t5-/m1/s1.
What are the key properties of (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine?
(4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine has a molecular weight of 129.23 g/mol, XLogP of 1.52, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3,4-dimethyl-5-methylidene-1,3-thiazolidine is sourced from PubChem (CID 155070776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).