2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine

C8H18N2O2S — CID 165475343

IUPAC2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine
SMILESCCCC1(C)C(N)CS(=O)(=O)N1C
InChIInChI=1S/C8H18N2O2S/c1-4-5-8(2)7(9)6-13(11,12)10(8)3/h7H,4-6,9H2,1-3H3
InChIKeyFXPDVLAIMOOQKE-UHFFFAOYSA-N
MW206.31 g/mol
LogP0.15
Rot. Bonds2

About 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine

2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine (PubChem CID 165475343) has the molecular formula C8H18N2O2S and a molecular weight of 206.31 g/mol. Its IUPAC name is 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine.

Molecular Properties

Compound Name2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine
PubChem CID165475343
Molecular FormulaC8H18N2O2S
Molecular Weight206.31 g/mol
Exact Mass206.11
IUPAC Name2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine
SMILESCCCC1(C)C(N)CS(=O)(=O)N1C
InChIInChI=1S/C8H18N2O2S/c1-4-5-8(2)7(9)6-13(11,12)10(8)3/h7H,4-6,9H2,1-3H3
InChIKeyFXPDVLAIMOOQKE-UHFFFAOYSA-N
XLogP0.15
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-ethyl-6,6-dioxo-6λ6-thia-5-azaspiro[3.4]octan-8-amine
CID 165485789
2,3,3-trimethyl-1,1-dioxo-1,2-thiazolidin-4-ol
CID 163338317
2,2-dimethyl-1,1-dioxothietan-3-amine
CID 75525635
(2S)-2,4-dimethyl-4-propyloxolane
CID 135257246
1-[(5R)-6,6-dimethyl-3,3-dioxo-5-propyl-3λ6-thia-2-azabicyclo[3.2.0]heptan-2-yl]propan-1-one
CID 155121139
1-(4-amino-3-methyloxolane-3-carbonyl)-4-propylpiperidine-4-carboxylic acid
CID 66262627
1-butyl-2,2,6,6-tetramethylpiperidin-4-amine
CID 19905643
3,5-dimethyl-5-propyloxan-2-one
CID 89207974
4-methyl-4-propyloxathietane 2,2-dioxide
CID 134926282
1-(4-amino-3-methyloxolan-3-yl)octan-1-one
CID 116563036
1,1,3-trimethyl-3-propylcyclopentane
CID 123680922
1-hydroxy-2,3,6-trimethyl-2,6-dipropylpiperidin-4-one
CID 91126366

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine?
The IUPAC name of 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine (CID 165475343) is 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine.
What is the SMILES notation for 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine?
The canonical SMILES for 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine is CCCC1(C)C(N)CS(=O)(=O)N1C.
What is the InChIKey of 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine?
The InChIKey is FXPDVLAIMOOQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O2S/c1-4-5-8(2)7(9)6-13(11,12)10(8)3/h7H,4-6,9H2,1-3H3.
What are the key properties of 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine?
2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine has a molecular weight of 206.31 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1,1-dioxo-3-propyl-1,2-thiazolidin-4-amine is sourced from PubChem (CID 165475343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).