8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide

C23H23N3O4S — CID 25044324

IUPAC8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2cccc3cccc(C(=O)N4CCCCC4)c23)cc1
InChIInChI=1S/C23H23N3O4S/c24-31(29,30)18-12-10-17(11-13-18)25-22(27)19-8-4-6-16-7-5-9-20(21(16)19)23(28)26-14-2-1-3-15-26/h4-13H,1-3,14-15H2,(H,25,27)(H2,24,29,30)
InChIKeyXXNBUGVEVCXULT-UHFFFAOYSA-N
MW437.52 g/mol
LogP3.37
Rot. Bonds4

About 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide

8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide (PubChem CID 25044324) has the molecular formula C23H23N3O4S and a molecular weight of 437.52 g/mol. Its IUPAC name is 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide.

Molecular Properties

Compound Name8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide
PubChem CID25044324
Molecular FormulaC23H23N3O4S
Molecular Weight437.52 g/mol
Exact Mass437.14
IUPAC Name8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2cccc3cccc(C(=O)N4CCCCC4)c23)cc1
InChIInChI=1S/C23H23N3O4S/c24-31(29,30)18-12-10-17(11-13-18)25-22(27)19-8-4-6-16-7-5-9-20(21(16)19)23(28)26-14-2-1-3-15-26/h4-13H,1-3,14-15H2,(H,25,27)(H2,24,29,30)
InChIKeyXXNBUGVEVCXULT-UHFFFAOYSA-N
XLogP3.37
TPSA109.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.52
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-sulfamoylphenyl)azocane-1-carboxamide
CID 17414007
(8-hydroxynaphthalen-1-yl)-piperidin-1-ylmethanone
CID 660137
8-(azepane-1-carbonyl)naphthalene-1-carboxylic acid
CID 16776667
8-(pyrrolidine-1-carbonyl)naphthalene-1-carboxylic acid
CID 16773543
8-[[3-[2-oxo-2-(4-sulfamoylanilino)ethyl]sulfanylphenyl]carbamoyl]naphthalene-1-carboxylic acid
CID 18897403
N-(4-sulfamoylphenyl)piperidine-1-carbothioamide
CID 19653686
N-[4-(pyrrolidine-1-carbonyl)phenyl]naphthalene-1-carboxamide
CID 2986145
2,3-difluoro-N-(4-sulfamoylphenyl)benzamide
CID 62649490
2,3-dimethyl-N-(4-sulfamoylphenyl)benzamide
CID 2814172
N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide
CID 26654878
2-[(4-sulfamoylphenyl)carbamoyl]cyclohexene-1-carboxylic acid
CID 53270897
CID 59587869
CID 59587869

Frequently Asked Questions

What is the IUPAC name of 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide?
The IUPAC name of 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide (CID 25044324) is 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide.
What is the SMILES notation for 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide?
The canonical SMILES for 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide is NS(=O)(=O)c1ccc(NC(=O)c2cccc3cccc(C(=O)N4CCCCC4)c23)cc1.
What is the InChIKey of 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide?
The InChIKey is XXNBUGVEVCXULT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O4S/c24-31(29,30)18-12-10-17(11-13-18)25-22(27)19-8-4-6-16-7-5-9-20(21(16)19)23(28)26-14-2-1-3-15-26/h4-13H,1-3,14-15H2,(H,25,27)(H2,24,29,30).
What are the key properties of 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide?
8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide has a molecular weight of 437.52 g/mol, XLogP of 3.37, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(piperidine-1-carbonyl)-N-(4-sulfamoylphenyl)naphthalene-1-carboxamide is sourced from PubChem (CID 25044324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).