N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide

C15H20N2O3S — CID 67121777

IUPACN-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H20N2O3S/c1-2-15(18)16-12-8-10-14(11-9-12)21(19,20)17-13-6-4-3-5-7-13/h2,8-11,13,17H,1,3-7H2,(H,16,18)
InChIKeyHHDINNWKAMBXSZ-UHFFFAOYSA-N
MW308.40 g/mol
LogP2.42
Rot. Bonds5

About N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide

N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide (PubChem CID 67121777) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide.

Molecular Properties

Compound NameN-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide
PubChem CID67121777
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC NameN-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide
SMILESC=CC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1
InChIInChI=1S/C15H20N2O3S/c1-2-15(18)16-12-8-10-14(11-9-12)21(19,20)17-13-6-4-3-5-7-13/h2,8-11,13,17H,1,3-7H2,(H,16,18)
InChIKeyHHDINNWKAMBXSZ-UHFFFAOYSA-N
XLogP2.42
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N,N'-bis[4-(cyclohexylsulfamoyl)phenyl]nonanediamide
CID 4629962
methyl N-[4-(cyclohexylsulfamoyl)phenyl]carbamate
CID 6465161
1-cyclopentyl-3-[4-(cyclopentylsulfamoyl)phenyl]urea
CID 119045085
N-[4-(cyclohexylsulfamoyl)phenyl]-3-(4-fluorophenyl)prop-2-enamide
CID 3456876
N-[4-(cyclohexylsulfamoyl)phenyl]-4-(prop-2-enylsulfamoyl)benzamide
CID 19258102
2,2-dichloro-N-[4-(cyclohexylsulfamoyl)phenyl]acetamide
CID 2228727
1-[4-(cyclopentylsulfamoyl)phenyl]-3-cyclopropylurea
CID 119045070
cis-(1S,2R)-2-[[4-(cyclohexylsulfamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 11839068
cis-(1R,2S)-2-[[4-(cyclohexylsulfamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 1015007
trans-(1S,2S)-2-[[4-(cyclohexylsulfamoyl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid
CID 51570846
N-[4-(cyclohexylsulfamoyl)phenyl]-3-(4-nitrophenyl)prop-2-enamide
CID 54561382
(E)-N-[4-(cyclohexylsulfamoyl)phenyl]-3-(4-ethylphenyl)prop-2-enamide
CID 19164284

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide?
The IUPAC name of N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide (CID 67121777) is N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide.
What is the SMILES notation for N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide?
The canonical SMILES for N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide is C=CC(=O)Nc1ccc(S(=O)(=O)NC2CCCCC2)cc1.
What is the InChIKey of N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide?
The InChIKey is HHDINNWKAMBXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c1-2-15(18)16-12-8-10-14(11-9-12)21(19,20)17-13-6-4-3-5-7-13/h2,8-11,13,17H,1,3-7H2,(H,16,18).
What are the key properties of N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide?
N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide has a molecular weight of 308.40 g/mol, XLogP of 2.42, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclohexylsulfamoyl)phenyl]prop-2-enamide is sourced from PubChem (CID 67121777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).