N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide

C14H20N2O3S — CID 64868078

IUPACN-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(C(=O)C2CCCCN2)cc1
InChIInChI=1S/C14H20N2O3S/c1-2-20(18,19)16-12-8-6-11(7-9-12)14(17)13-5-3-4-10-15-13/h6-9,13,15-16H,2-5,10H2,1H3
InChIKeyLEIQAKQIDQZAIX-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.77
Rot. Bonds5

About N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide

N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide (PubChem CID 64868078) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide.

Molecular Properties

Compound NameN-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide
PubChem CID64868078
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide
SMILESCCS(=O)(=O)Nc1ccc(C(=O)C2CCCCN2)cc1
InChIInChI=1S/C14H20N2O3S/c1-2-20(18,19)16-12-8-6-11(7-9-12)14(17)13-5-3-4-10-15-13/h6-9,13,15-16H,2-5,10H2,1H3
InChIKeyLEIQAKQIDQZAIX-UHFFFAOYSA-N
XLogP1.77
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(pyrrolidine-2-carbonyl)phenyl]methanesulfonamide
CID 64867866
N-[4-(ethylsulfonylamino)phenyl]pyrrolidine-2-carboxamide
CID 60946168
N-[4-(ethylsulfonylamino)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119282547
phenyl(piperidin-2-yl)methanone
CID 19772085
azepan-2-yl-(4-tert-butylphenyl)methanone
CID 70558460
N-[4-(methanesulfonamido)phenyl]piperidine-2-carboxamide
CID 43709925
(4-hexylphenyl)-piperidin-2-ylmethanone
CID 82341686
(2S)-N-[4-(ethylsulfamoyl)phenyl]piperidine-2-carboxamide
CID 103808975
N-[4-(2,2-dimethylcyclopropanecarbonyl)phenyl]ethanesulfonamide
CID 107000679
N-[4-(ethylsulfonylamino)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119711145
ethyl 4-(azepane-2-carbonylamino)benzoate
CID 64564434
N-(4-acetylphenyl)ethanesulfonamide
CID 1219330

Frequently Asked Questions

What is the IUPAC name of N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide?
The IUPAC name of N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide (CID 64868078) is N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide.
What is the SMILES notation for N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide?
The canonical SMILES for N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide is CCS(=O)(=O)Nc1ccc(C(=O)C2CCCCN2)cc1.
What is the InChIKey of N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide?
The InChIKey is LEIQAKQIDQZAIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-2-20(18,19)16-12-8-6-11(7-9-12)14(17)13-5-3-4-10-15-13/h6-9,13,15-16H,2-5,10H2,1H3.
What are the key properties of N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide?
N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide has a molecular weight of 296.39 g/mol, XLogP of 1.77, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(piperidine-2-carbonyl)phenyl]ethanesulfonamide is sourced from PubChem (CID 64868078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).