(E)-N-cyclohexylbut-2-ene-2-sulfonamide

C10H19NO2S — CID 139504300

IUPAC(E)-N-cyclohexylbut-2-ene-2-sulfonamide
SMILESC/C=C(\C)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C10H19NO2S/c1-3-9(2)14(12,13)11-10-7-5-4-6-8-10/h3,10-11H,4-8H2,1-2H3/b9-3+
InChIKeyZPMMFJQINXZIGY-YCRREMRBSA-N
MW217.33 g/mol
LogP2.16
Rot. Bonds3

About (E)-N-cyclohexylbut-2-ene-2-sulfonamide

(E)-N-cyclohexylbut-2-ene-2-sulfonamide (PubChem CID 139504300) has the molecular formula C10H19NO2S and a molecular weight of 217.33 g/mol. Its IUPAC name is (E)-N-cyclohexylbut-2-ene-2-sulfonamide.

Molecular Properties

Compound Name(E)-N-cyclohexylbut-2-ene-2-sulfonamide
PubChem CID139504300
Molecular FormulaC10H19NO2S
Molecular Weight217.33 g/mol
Exact Mass217.11
IUPAC Name(E)-N-cyclohexylbut-2-ene-2-sulfonamide
SMILESC/C=C(\C)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C10H19NO2S/c1-3-9(2)14(12,13)11-10-7-5-4-6-8-10/h3,10-11H,4-8H2,1-2H3/b9-3+
InChIKeyZPMMFJQINXZIGY-YCRREMRBSA-N
XLogP2.16
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.33
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (E)-N-cyclohexylbut-2-ene-2-sulfonamide?
The IUPAC name of (E)-N-cyclohexylbut-2-ene-2-sulfonamide (CID 139504300) is (E)-N-cyclohexylbut-2-ene-2-sulfonamide.
What is the SMILES notation for (E)-N-cyclohexylbut-2-ene-2-sulfonamide?
The canonical SMILES for (E)-N-cyclohexylbut-2-ene-2-sulfonamide is C/C=C(\C)S(=O)(=O)NC1CCCCC1.
What is the InChIKey of (E)-N-cyclohexylbut-2-ene-2-sulfonamide?
The InChIKey is ZPMMFJQINXZIGY-YCRREMRBSA-N. The full InChI is InChI=1S/C10H19NO2S/c1-3-9(2)14(12,13)11-10-7-5-4-6-8-10/h3,10-11H,4-8H2,1-2H3/b9-3+.
What are the key properties of (E)-N-cyclohexylbut-2-ene-2-sulfonamide?
(E)-N-cyclohexylbut-2-ene-2-sulfonamide has a molecular weight of 217.33 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-cyclohexylbut-2-ene-2-sulfonamide is sourced from PubChem (CID 139504300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).