4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide

C18H19FN2O3S — CID 2347525

IUPAC4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide
SMILESO=C(c1ccccc1NS(=O)(=O)c1ccc(F)cc1)N1CCCCC1
InChIInChI=1S/C18H19FN2O3S/c19-14-8-10-15(11-9-14)25(23,24)20-17-7-3-2-6-16(17)18(22)21-12-4-1-5-13-21/h2-3,6-11,20H,1,4-5,12-13H2
InChIKeyBBHQDBUQPQXYMG-UHFFFAOYSA-N
MW362.43 g/mol
LogP3.25
Rot. Bonds4

About 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide

4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide (PubChem CID 2347525) has the molecular formula C18H19FN2O3S and a molecular weight of 362.43 g/mol. Its IUPAC name is 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide
PubChem CID2347525
Molecular FormulaC18H19FN2O3S
Molecular Weight362.43 g/mol
Exact Mass362.11
IUPAC Name4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide
SMILESO=C(c1ccccc1NS(=O)(=O)c1ccc(F)cc1)N1CCCCC1
InChIInChI=1S/C18H19FN2O3S/c19-14-8-10-15(11-9-14)25(23,24)20-17-7-3-2-6-16(17)18(22)21-12-4-1-5-13-21/h2-3,6-11,20H,1,4-5,12-13H2
InChIKeyBBHQDBUQPQXYMG-UHFFFAOYSA-N
XLogP3.25
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.43
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-Benzyl-N-butyl-4-(N-phenylsulfamoyl)benzamide
CID 137796294
4-[2-(6-fluoro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)ethyl]benzenesulfonamide
CID 5155717
N-(4-methylphenyl)-3-(piperidin-1-ylcarbonyl)benzenesulfonamide
CID 2361079
2-(benzenesulfonamido)-N-(thiolan-3-yl)benzamide
CID 2805665
N-Phenyl-3-(1-piperidinylsulfonyl)benzamide
CID 558837
2-[[(4-Fluorophenyl)sulfonyl]amino]benzamide
CID 788806
2-[methyl(methylsulfonyl)amino]-N-[4-(1-piperidinylsulfonyl)phenyl]benzamide
CID 1228113
N-butyl-4-[(phenylsulfonyl)amino]benzamide
CID 2224401
4-(3,4-Dihydroquinolin-1(2h)-Ylcarbonyl)benzenesulfonamide
CID 91827503
N-Benzyl-2-(toluene-4-sulfonylamino)-benzamide
CID 3545567
4-[2-(7-fluoro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)ethyl]benzenesulfonamide
CID 127043469
3-[(dimethylamino)sulfonyl]-N-{2-[(4-methyl-1-piperidinyl)carbonyl]phenyl}benzamide
CID 992258

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide?
The IUPAC name of 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide (CID 2347525) is 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide?
The canonical SMILES for 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide is O=C(c1ccccc1NS(=O)(=O)c1ccc(F)cc1)N1CCCCC1.
What is the InChIKey of 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide?
The InChIKey is BBHQDBUQPQXYMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3S/c19-14-8-10-15(11-9-14)25(23,24)20-17-7-3-2-6-16(17)18(22)21-12-4-1-5-13-21/h2-3,6-11,20H,1,4-5,12-13H2.
What are the key properties of 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide?
4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide has a molecular weight of 362.43 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-(piperidine-1-carbonyl)phenyl]benzenesulfonamide is sourced from PubChem (CID 2347525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).