(3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide

C14H25NO2S — CID 143113200

IUPAC(3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide
SMILESCC/C=C\C(=C/CC)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C14H25NO2S/c1-3-5-12-14(9-4-2)18(16,17)15-13-10-7-6-8-11-13/h5,9,12-13,15H,3-4,6-8,10-11H2,1-2H3/b12-5-,14-9+
InChIKeyAAVYGBSNFLPURM-FTPHHNMSSA-N
MW271.43 g/mol
LogP3.50
Rot. Bonds6

About (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide

(3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide (PubChem CID 143113200) has the molecular formula C14H25NO2S and a molecular weight of 271.43 g/mol. Its IUPAC name is (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide.

Molecular Properties

Compound Name(3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide
PubChem CID143113200
Molecular FormulaC14H25NO2S
Molecular Weight271.43 g/mol
Exact Mass271.16
IUPAC Name(3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide
SMILESCC/C=C\C(=C/CC)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C14H25NO2S/c1-3-5-12-14(9-4-2)18(16,17)15-13-10-7-6-8-11-13/h5,9,12-13,15H,3-4,6-8,10-11H2,1-2H3/b12-5-,14-9+
InChIKeyAAVYGBSNFLPURM-FTPHHNMSSA-N
XLogP3.50
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.43
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-4-methylcyclohepta-1,3-diene-1-sulfinamide
CID 78027194
6-methyl-N-propan-2-ylhepta-2,4-diene-3-sulfonamide
CID 123150959
N-cyclohexylpenta-2,4-diene-2-sulfonamide
CID 123194677
N-cyclohex-2-en-1-ylpropane-2-sulfonamide
CID 131158057
N-butan-2-ylcyclohexa-1,5-diene-1-sulfonamide
CID 139478325
(E)-N-cyclohexylbut-2-ene-2-sulfonamide
CID 139504300
ethane;(2Z,4E)-N-(4-methylcyclohexyl)hepta-2,4-diene-4-sulfonamide
CID 143225625
(2E,4Z)-N-butylhepta-2,4-diene-3-sulfonamide;ethane;ethene
CID 143377507
N-cyclohexyl-2-methylcyclohexa-1,5-diene-1-sulfonamide
CID 143467549
N-cyclohexylbut-1-ene-1-sulfonamide
CID 153983005
N-propan-2-ylcyclohexene-1-sulfonamide
CID 155332302
2-methyl-N-propan-2-ylcyclohexa-1,5-diene-1-sulfonamide
CID 163971904

Frequently Asked Questions

What is the IUPAC name of (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide?
The IUPAC name of (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide (CID 143113200) is (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide.
What is the SMILES notation for (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide?
The canonical SMILES for (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide is CC/C=C\C(=C/CC)S(=O)(=O)NC1CCCCC1.
What is the InChIKey of (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide?
The InChIKey is AAVYGBSNFLPURM-FTPHHNMSSA-N. The full InChI is InChI=1S/C14H25NO2S/c1-3-5-12-14(9-4-2)18(16,17)15-13-10-7-6-8-11-13/h5,9,12-13,15H,3-4,6-8,10-11H2,1-2H3/b12-5-,14-9+.
What are the key properties of (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide?
(3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide has a molecular weight of 271.43 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide is sourced from PubChem (CID 143113200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).