N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide

C22H17N3O3S — CID 59656557

IUPACN-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)c2ccccc12)c1ccccc1
InChIInChI=1S/C22H17N3O3S/c26-22(16-8-2-1-3-9-16)24-19-13-14-20(18-11-5-4-10-17(18)19)29(27,28)25-21-12-6-7-15-23-21/h1-15H,(H,23,25)(H,24,26)
InChIKeyXREWDTLPFWKTFN-UHFFFAOYSA-N
MW403.46 g/mol
LogP4.29
Rot. Bonds5

About N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide

N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide (PubChem CID 59656557) has the molecular formula C22H17N3O3S and a molecular weight of 403.46 g/mol. Its IUPAC name is N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide.

Molecular Properties

Compound NameN-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide
PubChem CID59656557
Molecular FormulaC22H17N3O3S
Molecular Weight403.46 g/mol
Exact Mass403.10
IUPAC NameN-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)c2ccccc12)c1ccccc1
InChIInChI=1S/C22H17N3O3S/c26-22(16-8-2-1-3-9-16)24-19-13-14-20(18-11-5-4-10-17(18)19)29(27,28)25-21-12-6-7-15-23-21/h1-15H,(H,23,25)(H,24,26)
InChIKeyXREWDTLPFWKTFN-UHFFFAOYSA-N
XLogP4.29
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.46
LogP ≤ 54.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(4-phenylphenyl)sulfamoyl]naphthalen-1-yl]benzamide
CID 59656404
pyrazine;N-pyridin-2-ylbenzamide
CID 158820949
N-[4-[methoxy(phenyl)sulfamoyl]naphthalen-1-yl]pyridine-4-carboxamide
CID 91106510
N-[5-(cyclohexylsulfamoyl)naphthalen-1-yl]benzamide
CID 59718017
4-(methanesulfonamido)-N-pyridin-2-ylbenzamide
CID 42113789
3-(benzenesulfonamido)-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 92677705
N-(5-thiophen-2-ylsulfonylquinolin-8-yl)benzamide
CID 132603204
1-N-methyl-4-N-pyridin-2-ylbenzene-1,4-dicarboxamide
CID 145416212
3,4-dimethyl-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 1078179
2-[(4-hydroxybenzoyl)amino]-N-pyridin-2-ylbenzamide
CID 129127209
6-(pyridin-2-ylsulfamoyl)pyridine-3-carboxylic acid
CID 63872213
3-(propan-2-ylsulfamoyl)-N-pyridin-2-ylbenzamide
CID 35035772

Frequently Asked Questions

What is the IUPAC name of N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide?
The IUPAC name of N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide (CID 59656557) is N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide.
What is the SMILES notation for N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide?
The canonical SMILES for N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccccn2)c2ccccc12)c1ccccc1.
What is the InChIKey of N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide?
The InChIKey is XREWDTLPFWKTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N3O3S/c26-22(16-8-2-1-3-9-16)24-19-13-14-20(18-11-5-4-10-17(18)19)29(27,28)25-21-12-6-7-15-23-21/h1-15H,(H,23,25)(H,24,26).
What are the key properties of N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide?
N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide has a molecular weight of 403.46 g/mol, XLogP of 4.29, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(pyridin-2-ylsulfamoyl)naphthalen-1-yl]benzamide is sourced from PubChem (CID 59656557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).