2,2-bis(2-methylpropyl)-1,3-thiazolidine

C11H23NS — CID 18954518

IUPAC2,2-bis(2-methylpropyl)-1,3-thiazolidine
SMILESCC(C)CC1(CC(C)C)NCCS1
InChIInChI=1S/C11H23NS/c1-9(2)7-11(8-10(3)4)12-5-6-13-11/h9-10,12H,5-8H2,1-4H3
InChIKeyMKFWGPXERGCKOX-UHFFFAOYSA-N
MW201.38 g/mol
LogP3.11
Rot. Bonds4

About 2,2-bis(2-methylpropyl)-1,3-thiazolidine

2,2-bis(2-methylpropyl)-1,3-thiazolidine (PubChem CID 18954518) has the molecular formula C11H23NS and a molecular weight of 201.38 g/mol. Its IUPAC name is 2,2-bis(2-methylpropyl)-1,3-thiazolidine.

Molecular Properties

Compound Name2,2-bis(2-methylpropyl)-1,3-thiazolidine
PubChem CID18954518
Molecular FormulaC11H23NS
Molecular Weight201.38 g/mol
Exact Mass201.16
IUPAC Name2,2-bis(2-methylpropyl)-1,3-thiazolidine
SMILESCC(C)CC1(CC(C)C)NCCS1
InChIInChI=1S/C11H23NS/c1-9(2)7-11(8-10(3)4)12-5-6-13-11/h9-10,12H,5-8H2,1-4H3
InChIKeyMKFWGPXERGCKOX-UHFFFAOYSA-N
XLogP3.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.38
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,2-bis(2-methylpropyl)-1,3-thiazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-bis(2-methylpropyl)-1,3-thiazolidine?
The IUPAC name of 2,2-bis(2-methylpropyl)-1,3-thiazolidine (CID 18954518) is 2,2-bis(2-methylpropyl)-1,3-thiazolidine.
What is the SMILES notation for 2,2-bis(2-methylpropyl)-1,3-thiazolidine?
The canonical SMILES for 2,2-bis(2-methylpropyl)-1,3-thiazolidine is CC(C)CC1(CC(C)C)NCCS1.
What is the InChIKey of 2,2-bis(2-methylpropyl)-1,3-thiazolidine?
The InChIKey is MKFWGPXERGCKOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NS/c1-9(2)7-11(8-10(3)4)12-5-6-13-11/h9-10,12H,5-8H2,1-4H3.
What are the key properties of 2,2-bis(2-methylpropyl)-1,3-thiazolidine?
2,2-bis(2-methylpropyl)-1,3-thiazolidine has a molecular weight of 201.38 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(2-methylpropyl)-1,3-thiazolidine is sourced from PubChem (CID 18954518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).