1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide

C19H20FN3O4S — CID 17223695

IUPAC1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)c3cccc(F)c3)CC2)cc1
InChIInChI=1S/C19H20FN3O4S/c20-15-3-1-2-14(12-15)19(25)23-10-8-13(9-11-23)18(24)22-16-4-6-17(7-5-16)28(21,26)27/h1-7,12-13H,8-11H2,(H,22,24)(H2,21,26,27)
InChIKeyRPLUOSHDXQTZMG-UHFFFAOYSA-N
MW405.45 g/mol
LogP1.96
Rot. Bonds4

About 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide

1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide (PubChem CID 17223695) has the molecular formula C19H20FN3O4S and a molecular weight of 405.45 g/mol. Its IUPAC name is 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide
PubChem CID17223695
Molecular FormulaC19H20FN3O4S
Molecular Weight405.45 g/mol
Exact Mass405.12
IUPAC Name1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)c3cccc(F)c3)CC2)cc1
InChIInChI=1S/C19H20FN3O4S/c20-15-3-1-2-14(12-15)19(25)23-10-8-13(9-11-23)18(24)22-16-4-6-17(7-5-16)28(21,26)27/h1-7,12-13H,8-11H2,(H,22,24)(H2,21,26,27)
InChIKeyRPLUOSHDXQTZMG-UHFFFAOYSA-N
XLogP1.96
TPSA109.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.45
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-(cyclopropanecarbonylamino)benzoyl]-N-(4-sulfamoylphenyl)piperidine-4-carboxamide
CID 31589377
1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide
CID 17223576
N-[4-(dipropylsulfamoyl)phenyl]-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 17223755
N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 17223813
N-[4-(diethylamino)phenyl]-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 113008104
1-(3-aminobenzoyl)-N-(4-fluorophenyl)piperidine-4-carboxamide;hydrochloride
CID 119768112
propyl 4-[[1-(3-fluorobenzoyl)piperidine-4-carbonyl]amino]benzoate
CID 17223615
N-(3-chloro-4-methylphenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 17223687
1-benzoyl-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 110298375
1-(3-fluorobenzoyl)-N-pyridin-3-ylpiperidine-4-carboxamide
CID 17223654
N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113008221
1-(furan-2-carbonyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide
CID 6497474

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide (CID 17223695) is 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide is NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)c3cccc(F)c3)CC2)cc1.
What is the InChIKey of 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide?
The InChIKey is RPLUOSHDXQTZMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN3O4S/c20-15-3-1-2-14(12-15)19(25)23-10-8-13(9-11-23)18(24)22-16-4-6-17(7-5-16)28(21,26)27/h1-7,12-13H,8-11H2,(H,22,24)(H2,21,26,27).
What are the key properties of 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide?
1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide has a molecular weight of 405.45 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 17223695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).