N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide

C10H19NO4S2 — CID 18593873

IUPACN-cyclohexyl-1,1-dioxothiolane-3-sulfonamide
SMILESO=S1(=O)CCC(S(=O)(=O)NC2CCCCC2)C1
InChIInChI=1S/C10H19NO4S2/c12-16(13)7-6-10(8-16)17(14,15)11-9-4-2-1-3-5-9/h9-11H,1-8H2
InChIKeySOKOUYKUUXMQNF-UHFFFAOYSA-N
MW281.40 g/mol
LogP0.43
Rot. Bonds3

About N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide

N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide (PubChem CID 18593873) has the molecular formula C10H19NO4S2 and a molecular weight of 281.40 g/mol. Its IUPAC name is N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-1,1-dioxothiolane-3-sulfonamide
PubChem CID18593873
Molecular FormulaC10H19NO4S2
Molecular Weight281.40 g/mol
Exact Mass281.08
IUPAC NameN-cyclohexyl-1,1-dioxothiolane-3-sulfonamide
SMILESO=S1(=O)CCC(S(=O)(=O)NC2CCCCC2)C1
InChIInChI=1S/C10H19NO4S2/c12-16(13)7-6-10(8-16)17(14,15)11-9-4-2-1-3-5-9/h9-11H,1-8H2
InChIKeySOKOUYKUUXMQNF-UHFFFAOYSA-N
XLogP0.43
TPSA80.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide?
The IUPAC name of N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide (CID 18593873) is N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide.
What is the SMILES notation for N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide?
The canonical SMILES for N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide is O=S1(=O)CCC(S(=O)(=O)NC2CCCCC2)C1.
What is the InChIKey of N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide?
The InChIKey is SOKOUYKUUXMQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO4S2/c12-16(13)7-6-10(8-16)17(14,15)11-9-4-2-1-3-5-9/h9-11H,1-8H2.
What are the key properties of N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide?
N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide has a molecular weight of 281.40 g/mol, XLogP of 0.43, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1,1-dioxothiolane-3-sulfonamide is sourced from PubChem (CID 18593873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).