(3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide

C15H25NO2S — CID 130349602

IUPAC(3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide
SMILESC=C(/C=C\C(C)=C/C)S(=O)(=O)N(C)C1CCCCC1
InChIInChI=1S/C15H25NO2S/c1-5-13(2)11-12-14(3)19(17,18)16(4)15-9-7-6-8-10-15/h5,11-12,15H,3,6-10H2,1-2,4H3/b12-11-,13-5-
InChIKeyXYLXJLLQQBYZTP-KVXUBGLVSA-N
MW283.44 g/mol
LogP3.62
Rot. Bonds5

About (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide

(3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide (PubChem CID 130349602) has the molecular formula C15H25NO2S and a molecular weight of 283.44 g/mol. Its IUPAC name is (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide.

Molecular Properties

Compound Name(3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide
PubChem CID130349602
Molecular FormulaC15H25NO2S
Molecular Weight283.44 g/mol
Exact Mass283.16
IUPAC Name(3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide
SMILESC=C(/C=C\C(C)=C/C)S(=O)(=O)N(C)C1CCCCC1
InChIInChI=1S/C15H25NO2S/c1-5-13(2)11-12-14(3)19(17,18)16(4)15-9-7-6-8-10-15/h5,11-12,15H,3,6-10H2,1-2,4H3/b12-11-,13-5-
InChIKeyXYLXJLLQQBYZTP-KVXUBGLVSA-N
XLogP3.62
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide?
The IUPAC name of (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide (CID 130349602) is (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide.
What is the SMILES notation for (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide?
The canonical SMILES for (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide is C=C(/C=C\C(C)=C/C)S(=O)(=O)N(C)C1CCCCC1.
What is the InChIKey of (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide?
The InChIKey is XYLXJLLQQBYZTP-KVXUBGLVSA-N. The full InChI is InChI=1S/C15H25NO2S/c1-5-13(2)11-12-14(3)19(17,18)16(4)15-9-7-6-8-10-15/h5,11-12,15H,3,6-10H2,1-2,4H3/b12-11-,13-5-.
What are the key properties of (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide?
(3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide has a molecular weight of 283.44 g/mol, XLogP of 3.62, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-N-cyclohexyl-N,5-dimethylhepta-1,3,5-triene-2-sulfonamide is sourced from PubChem (CID 130349602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).