N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide

C15H20N2O3S — CID 135020255

IUPACN'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide
SMILESCC(=O)N(NC1C=CCCC1)S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C15H20N2O3S/c1-12-8-10-15(11-9-12)21(19,20)17(13(2)18)16-14-6-4-3-5-7-14/h4,6,8-11,14,16H,3,5,7H2,1-2H3
InChIKeyZAUXCAKZKSSKFH-UHFFFAOYSA-N
MW308.40 g/mol
LogP2.15
Rot. Bonds4

About N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide

N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide (PubChem CID 135020255) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide.

Molecular Properties

Compound NameN'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide
PubChem CID135020255
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC NameN'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide
SMILESCC(=O)N(NC1C=CCCC1)S(=O)(=O)c1ccc(C)cc1
InChIInChI=1S/C15H20N2O3S/c1-12-8-10-15(11-9-12)21(19,20)17(13(2)18)16-14-6-4-3-5-7-14/h4,6,8-11,14,16H,3,5,7H2,1-2H3
InChIKeyZAUXCAKZKSSKFH-UHFFFAOYSA-N
XLogP2.15
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-Cyclohexyl-4-methylbenzenesulfonamide
CID 6633
cyclohexyl-N-{[(4-methylphenyl)sulfonyl]amino}carboxamide
CID 3139318
1-[(4-methylphenyl)sulfonyl]tetrahydro-3H-pyrazol-3-one
CID 1487856
2-cyano-N'-[(4-methylphenyl)sulfonyl]acetohydrazide
CID 5035758
Pcmd-CC-mcm-23
CID 11834388
Hexanamide, 6-[[(4-methylphenyl)sulfonyl]amino]-
CID 2447482
N-(2-hydrazinyl-2-oxoethyl)-4-methylbenzenesulfonamide
CID 562881
N-(1-Hydrazinocarbonyl-2-phenyl-ethyl)-4-methyl-benzenesulfonamide
CID 3132811
(E)-N'-methyl-N'-(4-methylphenyl)sulfonyl-3-phenylprop-2-enehydrazide
CID 13634917
Benzenesulfonamide, N-2-cyclohexen-1-yl-4-methyl-
CID 11107808
2-(p-Toluene sulfonyl)-L-glutamic acid hydrazide
CID 388354
4-Methyl-2-[(4-methylphenyl)sulfonylamino]pentanamide
CID 16275079

Frequently Asked Questions

What is the IUPAC name of N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide?
The IUPAC name of N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide (CID 135020255) is N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide.
What is the SMILES notation for N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide?
The canonical SMILES for N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide is CC(=O)N(NC1C=CCCC1)S(=O)(=O)c1ccc(C)cc1.
What is the InChIKey of N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide?
The InChIKey is ZAUXCAKZKSSKFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c1-12-8-10-15(11-9-12)21(19,20)17(13(2)18)16-14-6-4-3-5-7-14/h4,6,8-11,14,16H,3,5,7H2,1-2H3.
What are the key properties of N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide?
N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide has a molecular weight of 308.40 g/mol, XLogP of 2.15, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohex-2-en-1-yl-N-(4-methylphenyl)sulfonylacetohydrazide is sourced from PubChem (CID 135020255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).