N-cyclohexylpenta-2,4-diene-2-sulfonamide

C11H19NO2S — CID 123194677

IUPACN-cyclohexylpenta-2,4-diene-2-sulfonamide
SMILESC=CC=C(C)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C11H19NO2S/c1-3-7-10(2)15(13,14)12-11-8-5-4-6-9-11/h3,7,11-12H,1,4-6,8-9H2,2H3
InChIKeyVXEPWPNNNFMGGH-UHFFFAOYSA-N
MW229.34 g/mol
LogP2.33
Rot. Bonds4

About N-cyclohexylpenta-2,4-diene-2-sulfonamide

N-cyclohexylpenta-2,4-diene-2-sulfonamide (PubChem CID 123194677) has the molecular formula C11H19NO2S and a molecular weight of 229.34 g/mol. Its IUPAC name is N-cyclohexylpenta-2,4-diene-2-sulfonamide.

Molecular Properties

Compound NameN-cyclohexylpenta-2,4-diene-2-sulfonamide
PubChem CID123194677
Molecular FormulaC11H19NO2S
Molecular Weight229.34 g/mol
Exact Mass229.11
IUPAC NameN-cyclohexylpenta-2,4-diene-2-sulfonamide
SMILESC=CC=C(C)S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C11H19NO2S/c1-3-7-10(2)15(13,14)12-11-8-5-4-6-9-11/h3,7,11-12H,1,4-6,8-9H2,2H3
InChIKeyVXEPWPNNNFMGGH-UHFFFAOYSA-N
XLogP2.33
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.34
LogP ≤ 52.33
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

(2Z,4E,6E)-N-cyclohexyl-8,8,8-trifluoro-7-methylocta-2,4,6-triene-4-sulfonamide
CID 144195573
N-(2-aminocyclohexyl)methanesulfonamide;benzene;ruthenium(2+)
CID 87791992
5-chloro-N-cyclohexylcyclohepta-1,3,4,6-tetraene-1-sulfonamide
CID 91372896
(E)-N-cyclohexylbut-2-ene-2-sulfonamide
CID 139504300
(3E,5Z)-N-cyclohexylocta-3,5-diene-4-sulfonamide
CID 143113200
[(Cyclohexylamino)-(1-methylthiopyran-2-yl)-oxo-lambda6-sulfanylidene]oxidanium
CID 143180339
N-cyclohexyl-2-methylcyclohexa-1,5-diene-1-sulfonamide
CID 143467549
N-cyclohexylprop-1-ene-1-sulfonamide
CID 154204708
(3E)-N-butylhexa-1,3,5-triene-3-sulfonamide;molecular hydrogen
CID 170766238
N-cyclohexylprop-2-ene-1-sulfonamide
CID 78925210
N-cyclohexylcyclopenta-2,4-diene-1-sulfonamide
CID 129653153
N-cyclohexyl-1-methylthiopyran-2-sulfonamide
CID 143180340

Frequently Asked Questions

What is the IUPAC name of N-cyclohexylpenta-2,4-diene-2-sulfonamide?
The IUPAC name of N-cyclohexylpenta-2,4-diene-2-sulfonamide (CID 123194677) is N-cyclohexylpenta-2,4-diene-2-sulfonamide.
What is the SMILES notation for N-cyclohexylpenta-2,4-diene-2-sulfonamide?
The canonical SMILES for N-cyclohexylpenta-2,4-diene-2-sulfonamide is C=CC=C(C)S(=O)(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexylpenta-2,4-diene-2-sulfonamide?
The InChIKey is VXEPWPNNNFMGGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2S/c1-3-7-10(2)15(13,14)12-11-8-5-4-6-9-11/h3,7,11-12H,1,4-6,8-9H2,2H3.
What are the key properties of N-cyclohexylpenta-2,4-diene-2-sulfonamide?
N-cyclohexylpenta-2,4-diene-2-sulfonamide has a molecular weight of 229.34 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylpenta-2,4-diene-2-sulfonamide is sourced from PubChem (CID 123194677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).