2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide

C9H19NO2S — CID 122434175

IUPAC2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide
SMILESCC(C)C1CCS(=O)(=O)N1C(C)C
InChIInChI=1S/C9H19NO2S/c1-7(2)9-5-6-13(11,12)10(9)8(3)4/h7-9H,5-6H2,1-4H3
InChIKeyLZJCIBVQNFBLRX-UHFFFAOYSA-N
MW205.32 g/mol
LogP1.45
Rot. Bonds2

About 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide

2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide (PubChem CID 122434175) has the molecular formula C9H19NO2S and a molecular weight of 205.32 g/mol. Its IUPAC name is 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide.

Molecular Properties

Compound Name2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide
PubChem CID122434175
Molecular FormulaC9H19NO2S
Molecular Weight205.32 g/mol
Exact Mass205.11
IUPAC Name2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide
SMILESCC(C)C1CCS(=O)(=O)N1C(C)C
InChIInChI=1S/C9H19NO2S/c1-7(2)9-5-6-13(11,12)10(9)8(3)4/h7-9H,5-6H2,1-4H3
InChIKeyLZJCIBVQNFBLRX-UHFFFAOYSA-N
XLogP1.45
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.32
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide?
The IUPAC name of 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide (CID 122434175) is 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide.
What is the SMILES notation for 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide?
The canonical SMILES for 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide is CC(C)C1CCS(=O)(=O)N1C(C)C.
What is the InChIKey of 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide?
The InChIKey is LZJCIBVQNFBLRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2S/c1-7(2)9-5-6-13(11,12)10(9)8(3)4/h7-9H,5-6H2,1-4H3.
What are the key properties of 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide?
2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide has a molecular weight of 205.32 g/mol, XLogP of 1.45, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-di(propan-2-yl)-1,2-thiazolidine 1,1-dioxide is sourced from PubChem (CID 122434175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).