N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide

C15H21N3O3S — CID 2990833

IUPACN-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide
SMILESC=CCNS(=O)(=O)c1ccc(NC(=O)N2CCCCC2)cc1
InChIInChI=1S/C15H21N3O3S/c1-2-10-16-22(20,21)14-8-6-13(7-9-14)17-15(19)18-11-4-3-5-12-18/h2,6-9,16H,1,3-5,10-12H2,(H,17,19)
InChIKeyULPWJKUTRXNEBF-UHFFFAOYSA-N
MW323.42 g/mol
LogP2.17
Rot. Bonds5

About N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide

N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide (PubChem CID 2990833) has the molecular formula C15H21N3O3S and a molecular weight of 323.42 g/mol. Its IUPAC name is N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide
PubChem CID2990833
Molecular FormulaC15H21N3O3S
Molecular Weight323.42 g/mol
Exact Mass323.13
IUPAC NameN-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide
SMILESC=CCNS(=O)(=O)c1ccc(NC(=O)N2CCCCC2)cc1
InChIInChI=1S/C15H21N3O3S/c1-2-10-16-22(20,21)14-8-6-13(7-9-14)17-15(19)18-11-4-3-5-12-18/h2,6-9,16H,1,3-5,10-12H2,(H,17,19)
InChIKeyULPWJKUTRXNEBF-UHFFFAOYSA-N
XLogP2.17
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[4-(propylsulfamoyl)phenyl]piperidine-1-carboxamide
CID 2987866
N-(4-piperidin-1-ylphenyl)-4-(prop-2-enylsulfamoyl)benzamide
CID 17473471
N-[4-(butylsulfamoyl)phenyl]pyrrolidine-1-carboxamide
CID 2991195
N-(4-sulfamoylphenyl)azocane-1-carboxamide
CID 17414007
[2-(azocan-1-yl)-2-oxoethyl] 4-(prop-2-enylsulfamoyl)benzoate
CID 8568392
N-[4-[(2-prop-2-enylsulfanylacetyl)amino]phenyl]azepane-1-carboxamide
CID 51100780
N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide
CID 6460433
N,N'-bis[4-(prop-2-enylsulfamoyl)phenyl]nonanediamide
CID 4930373
N-(3-oxo-3-pyrrolidin-1-ylpropyl)-4-(prop-2-enylsulfamoyl)benzamide
CID 9453861
4-(prop-2-enylsulfamoyl)benzoic acid
CID 2512621
2-methyl-N-[4-(prop-2-enylsulfamoyl)phenyl]propanamide
CID 6467571
2-chloro-N-[4-(prop-2-enylsulfamoyl)phenyl]benzamide
CID 2989337

Frequently Asked Questions

What is the IUPAC name of N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide?
The IUPAC name of N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide (CID 2990833) is N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide.
What is the SMILES notation for N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide?
The canonical SMILES for N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide is C=CCNS(=O)(=O)c1ccc(NC(=O)N2CCCCC2)cc1.
What is the InChIKey of N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide?
The InChIKey is ULPWJKUTRXNEBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3S/c1-2-10-16-22(20,21)14-8-6-13(7-9-14)17-15(19)18-11-4-3-5-12-18/h2,6-9,16H,1,3-5,10-12H2,(H,17,19).
What are the key properties of N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide?
N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide has a molecular weight of 323.42 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide is sourced from PubChem (CID 2990833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).