1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol

C8H15NO3S — CID 104549613

IUPAC1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol
SMILESO=S1(=O)CCCN1CC(O)C1CC1
InChIInChI=1S/C8H15NO3S/c10-8(7-2-3-7)6-9-4-1-5-13(9,11)12/h7-8,10H,1-6H2
InChIKeyHNECDPIHLBSVNB-UHFFFAOYSA-N
MW205.28 g/mol
LogP-0.21
Rot. Bonds3

About 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol

1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol (PubChem CID 104549613) has the molecular formula C8H15NO3S and a molecular weight of 205.28 g/mol. Its IUPAC name is 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol.

Molecular Properties

Compound Name1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol
PubChem CID104549613
Molecular FormulaC8H15NO3S
Molecular Weight205.28 g/mol
Exact Mass205.08
IUPAC Name1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol
SMILESO=S1(=O)CCCN1CC(O)C1CC1
InChIInChI=1S/C8H15NO3S/c10-8(7-2-3-7)6-9-4-1-5-13(9,11)12/h7-8,10H,1-6H2
InChIKeyHNECDPIHLBSVNB-UHFFFAOYSA-N
XLogP-0.21
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3S)-1-cyclopropylsulfonylpyrrolidin-3-yl]methanol
CID 164629585
3-(7-Hydroxy-5-azaspiro[2.4]heptane-5-yl)propylmethanesulfonate
CID 86645607
1-Ethylsulfonyl-4-propan-2-ylpyrrolidin-3-ol
CID 145766796
1-[(1-Methylcyclopropyl)methylsulfonyl]pyrrolidin-3-ol
CID 163670901
1-(3-Methylbutylsulfonyl)pyrrolidin-3-ol
CID 63857865
1-Cyclopropanesulfonylpyrrolidin-3-ol
CID 64552222
(1-Cyclopropylsulfonylpyrrolidin-3-yl)methanol
CID 64555168
[1-(Cyclopropylmethylsulfonyl)pyrrolidin-2-yl]methanol
CID 64987340
1-(Cyclopropylmethylsulfonyl)pyrrolidin-3-ol
CID 64987623
1-(Cyclopropylmethylsulfonyl)piperidin-3-ol
CID 64987994
[(2S)-1-(cyclopropylmethylsulfonyl)pyrrolidin-2-yl]methanol
CID 66260976
(3S)-1-(Cyclopropanesulfonyl)pyrrolidin-3-ol
CID 66291199

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol?
The IUPAC name of 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol (CID 104549613) is 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol.
What is the SMILES notation for 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol?
The canonical SMILES for 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol is O=S1(=O)CCCN1CC(O)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol?
The InChIKey is HNECDPIHLBSVNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3S/c10-8(7-2-3-7)6-9-4-1-5-13(9,11)12/h7-8,10H,1-6H2.
What are the key properties of 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol?
1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol has a molecular weight of 205.28 g/mol, XLogP of -0.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(1,1-dioxo-1,2-thiazolidin-2-yl)ethanol is sourced from PubChem (CID 104549613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).