2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide

C8H16N2O2S — CID 117026527

IUPAC2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide
SMILESCN1CCN(C2CCCC2)S1(=O)=O
InChIInChI=1S/C8H16N2O2S/c1-9-6-7-10(13(9,11)12)8-4-2-3-5-8/h8H,2-7H2,1H3
InChIKeyDNSHYYZQQDDUGD-UHFFFAOYSA-N
MW204.29 g/mol
LogP0.42
Rot. Bonds1

About 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide

2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide (PubChem CID 117026527) has the molecular formula C8H16N2O2S and a molecular weight of 204.29 g/mol. Its IUPAC name is 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide.

Molecular Properties

Compound Name2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide
PubChem CID117026527
Molecular FormulaC8H16N2O2S
Molecular Weight204.29 g/mol
Exact Mass204.09
IUPAC Name2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide
SMILESCN1CCN(C2CCCC2)S1(=O)=O
InChIInChI=1S/C8H16N2O2S/c1-9-6-7-10(13(9,11)12)8-4-2-3-5-8/h8H,2-7H2,1H3
InChIKeyDNSHYYZQQDDUGD-UHFFFAOYSA-N
XLogP0.42
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 50.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-6-methyl-1,2,6-thiadiazinane 1,1-dioxide
CID 117026594
2,7-dimethyl-1,2,7-thiadiazepane 1,1-dioxide
CID 59417812
2-cyclopentyl-5-(piperidin-4-ylmethyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 84814080
2-cyclopentyl-4-(4-methylpiperazin-1-yl)-1,2-thiazolidine 1,1-dioxide
CID 51360708
2-[(3aR)-1,1-dioxo-3,3a,4,5,6,7-hexahydro-[1,2,5]thiadiazolo[2,3-a]pyridin-2-yl]ethanamine
CID 129498202
2-(5-cyclopropyl-1,1-dioxo-1,2,5-thiadiazolidin-2-yl)-2-methylpropanoic acid
CID 58738228
2-[(3aS)-1,1-dioxo-3a,4,5,6-tetrahydro-3H-pyrrolo[1,2-b][1,2,5]thiadiazol-2-yl]ethanol
CID 129497638
11-methyl-11-azabicyclo[4.4.1]undecane
CID 580203
2-cyclopropyl-6-[(3R)-pyrrolidin-3-yl]-1,2,6-thiadiazinane 1,1-dioxide
CID 129409583
(7S)-12-methyl-12-azabicyclo[5.4.1]dodecane
CID 126565755
(3aR)-3,3a,4,5,6,7-hexahydrooxathiazolo[3,4-a]pyridine 1,1-dioxide
CID 23255920
2-cyclopentyl-4-methyl-1,2,5-thiadiazepane 1,1-dioxide
CID 117016628

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide?
The IUPAC name of 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide (CID 117026527) is 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide.
What is the SMILES notation for 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide?
The canonical SMILES for 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide is CN1CCN(C2CCCC2)S1(=O)=O.
What is the InChIKey of 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide?
The InChIKey is DNSHYYZQQDDUGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O2S/c1-9-6-7-10(13(9,11)12)8-4-2-3-5-8/h8H,2-7H2,1H3.
What are the key properties of 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide?
2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide has a molecular weight of 204.29 g/mol, XLogP of 0.42, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-methyl-1,2,5-thiadiazolidine 1,1-dioxide is sourced from PubChem (CID 117026527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).