[4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol

C10H19NO3S — CID 135173595

IUPAC[4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol
SMILESO=S1(=O)CCCN1C1CCC(CO)CC1
InChIInChI=1S/C10H19NO3S/c12-8-9-2-4-10(5-3-9)11-6-1-7-15(11,13)14/h9-10,12H,1-8H2
InChIKeyQEZICJQDKKHKRW-UHFFFAOYSA-N
MW233.33 g/mol
LogP0.57
Rot. Bonds2

About [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol

[4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol (PubChem CID 135173595) has the molecular formula C10H19NO3S and a molecular weight of 233.33 g/mol. Its IUPAC name is [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol
PubChem CID135173595
Molecular FormulaC10H19NO3S
Molecular Weight233.33 g/mol
Exact Mass233.11
IUPAC Name[4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol
SMILESO=S1(=O)CCCN1C1CCC(CO)CC1
InChIInChI=1S/C10H19NO3S/c12-8-9-2-4-10(5-3-9)11-6-1-7-15(11,13)14/h9-10,12H,1-8H2
InChIKeyQEZICJQDKKHKRW-UHFFFAOYSA-N
XLogP0.57
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol?
The IUPAC name of [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol (CID 135173595) is [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol.
What is the SMILES notation for [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol?
The canonical SMILES for [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol is O=S1(=O)CCCN1C1CCC(CO)CC1.
What is the InChIKey of [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol?
The InChIKey is QEZICJQDKKHKRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3S/c12-8-9-2-4-10(5-3-9)11-6-1-7-15(11,13)14/h9-10,12H,1-8H2.
What are the key properties of [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol?
[4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol has a molecular weight of 233.33 g/mol, XLogP of 0.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1,1-dioxo-1,2-thiazolidin-2-yl)cyclohexyl]methanol is sourced from PubChem (CID 135173595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).