4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine

C9H17NS — CID 134391108

IUPAC4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine
SMILESCC1NC(C)(C2CCC2)CS1
InChIInChI=1S/C9H17NS/c1-7-10-9(2,6-11-7)8-4-3-5-8/h7-8,10H,3-6H2,1-2H3
InChIKeyFBSDXIHWLOIMKT-UHFFFAOYSA-N
MW171.31 g/mol
LogP2.23
Rot. Bonds1

About 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine

4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine (PubChem CID 134391108) has the molecular formula C9H17NS and a molecular weight of 171.31 g/mol. Its IUPAC name is 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine.

Molecular Properties

Compound Name4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine
PubChem CID134391108
Molecular FormulaC9H17NS
Molecular Weight171.31 g/mol
Exact Mass171.11
IUPAC Name4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine
SMILESCC1NC(C)(C2CCC2)CS1
InChIInChI=1S/C9H17NS/c1-7-10-9(2,6-11-7)8-4-3-5-8/h7-8,10H,3-6H2,1-2H3
InChIKeyFBSDXIHWLOIMKT-UHFFFAOYSA-N
XLogP2.23
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.31
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine?
The IUPAC name of 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine (CID 134391108) is 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine.
What is the SMILES notation for 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine?
The canonical SMILES for 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine is CC1NC(C)(C2CCC2)CS1.
What is the InChIKey of 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine?
The InChIKey is FBSDXIHWLOIMKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NS/c1-7-10-9(2,6-11-7)8-4-3-5-8/h7-8,10H,3-6H2,1-2H3.
What are the key properties of 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine?
4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine has a molecular weight of 171.31 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyl-2,4-dimethyl-1,3-thiazolidine is sourced from PubChem (CID 134391108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).