4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide

C10H21NO2S — CID 118445885

IUPAC4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide
SMILESCC(C)N1CS(=O)(=O)CC1C(C)(C)C
InChIInChI=1S/C10H21NO2S/c1-8(2)11-7-14(12,13)6-9(11)10(3,4)5/h8-9H,6-7H2,1-5H3
InChIKeyXKZAQPSEBBBJRC-UHFFFAOYSA-N
MW219.35 g/mol
LogP1.50
Rot. Bonds1

About 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide

4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide (PubChem CID 118445885) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide.

Molecular Properties

Compound Name4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide
PubChem CID118445885
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC Name4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide
SMILESCC(C)N1CS(=O)(=O)CC1C(C)(C)C
InChIInChI=1S/C10H21NO2S/c1-8(2)11-7-14(12,13)6-9(11)10(3,4)5/h8-9H,6-7H2,1-5H3
InChIKeyXKZAQPSEBBBJRC-UHFFFAOYSA-N
XLogP1.50
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 51.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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(4R)-2-tert-butyl-4-methylsulfonyl-1-propan-2-ylpyrrolidine
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3,4-di(propan-2-yl)-1,4-thiazinane 1,1-dioxide
CID 153277891
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Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide?
The IUPAC name of 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide (CID 118445885) is 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide.
What is the SMILES notation for 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide?
The canonical SMILES for 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide is CC(C)N1CS(=O)(=O)CC1C(C)(C)C.
What is the InChIKey of 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide?
The InChIKey is XKZAQPSEBBBJRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c1-8(2)11-7-14(12,13)6-9(11)10(3,4)5/h8-9H,6-7H2,1-5H3.
What are the key properties of 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide?
4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide has a molecular weight of 219.35 g/mol, XLogP of 1.50, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-3-propan-2-yl-1,3-thiazolidine 1,1-dioxide is sourced from PubChem (CID 118445885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).