2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide

C10H19NO2S — CID 59254837

IUPAC2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide
SMILESCC1CCC(N2CCCS2(=O)=O)CC1
InChIInChI=1S/C10H19NO2S/c1-9-3-5-10(6-4-9)11-7-2-8-14(11,12)13/h9-10H,2-8H2,1H3
InChIKeyMXJOKWYTCGHHFF-UHFFFAOYSA-N
MW217.33 g/mol
LogP1.60
Rot. Bonds1

About 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide

2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide (PubChem CID 59254837) has the molecular formula C10H19NO2S and a molecular weight of 217.33 g/mol. Its IUPAC name is 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide.

Molecular Properties

Compound Name2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide
PubChem CID59254837
Molecular FormulaC10H19NO2S
Molecular Weight217.33 g/mol
Exact Mass217.11
IUPAC Name2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide
SMILESCC1CCC(N2CCCS2(=O)=O)CC1
InChIInChI=1S/C10H19NO2S/c1-9-3-5-10(6-4-9)11-7-2-8-14(11,12)13/h9-10H,2-8H2,1H3
InChIKeyMXJOKWYTCGHHFF-UHFFFAOYSA-N
XLogP1.60
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.33
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(R)-1-((S)-2-Methyl-propane-2-sulfinyl)-2-cyclohexyl-pyrrolidine
CID 46188855
(S)-1-((S)-2-Methyl-propane-2-sulfinyl)-2-cyclohexyl pyrrolidine
CID 67330440
1-(Cyclohexylmethylsulfonyl)pyrrolidine
CID 62732740
(2S)-2-cyclohexyl-1-methylsulfonylpyrrolidine
CID 95358786
(2S)-N,2-dimethyl-N-(4-methylcyclohexyl)pentane-1-sulfonamide
CID 99807776
(2S)-2-cyclohexyl-1-(3,3-dimethylbutylsulfonyl)pyrrolidine
CID 99807778
1-Butylsulfonyl-2-propan-2-ylpyrrolidine
CID 110728284
(2R)-1-butylsulfonyl-2-propan-2-ylpyrrolidine
CID 155936753
N-methyl-N-(4-methylcyclohexyl)methanesulfonamide
CID 57678202
3,4,5-Trimethyl-2-propan-2-yl-1,2-thiazolidine 1,1-dioxide
CID 57870643
N-methyl-N-(4-methylcyclohexyl)cyclopropanesulfonamide
CID 58394512
N-cyclohexyl-N-ethyl-3-methylbutane-1-sulfonamide
CID 58689101

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide?
The IUPAC name of 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide (CID 59254837) is 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide.
What is the SMILES notation for 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide?
The canonical SMILES for 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide is CC1CCC(N2CCCS2(=O)=O)CC1.
What is the InChIKey of 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide?
The InChIKey is MXJOKWYTCGHHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2S/c1-9-3-5-10(6-4-9)11-7-2-8-14(11,12)13/h9-10H,2-8H2,1H3.
What are the key properties of 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide?
2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide has a molecular weight of 217.33 g/mol, XLogP of 1.60, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylcyclohexyl)-1,2-thiazolidine 1,1-dioxide is sourced from PubChem (CID 59254837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).