N-(4-sulfamoylphenyl)naphthalene-1-carboxamide

C17H14N2O3S — CID 788220

IUPACN-(4-sulfamoylphenyl)naphthalene-1-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C17H14N2O3S/c18-23(21,22)14-10-8-13(9-11-14)19-17(20)16-7-3-5-12-4-1-2-6-15(12)16/h1-11H,(H,19,20)(H2,18,21,22)
InChIKeyHLCBREWTMQSKSD-UHFFFAOYSA-N
MW326.38 g/mol
LogP2.74
Rot. Bonds3

About N-(4-sulfamoylphenyl)naphthalene-1-carboxamide

N-(4-sulfamoylphenyl)naphthalene-1-carboxamide (PubChem CID 788220) has the molecular formula C17H14N2O3S and a molecular weight of 326.38 g/mol. Its IUPAC name is N-(4-sulfamoylphenyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(4-sulfamoylphenyl)naphthalene-1-carboxamide
PubChem CID788220
Molecular FormulaC17H14N2O3S
Molecular Weight326.38 g/mol
Exact Mass326.07
IUPAC NameN-(4-sulfamoylphenyl)naphthalene-1-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C17H14N2O3S/c18-23(21,22)14-10-8-13(9-11-14)19-17(20)16-7-3-5-12-4-1-2-6-15(12)16/h1-11H,(H,19,20)(H2,18,21,22)
InChIKeyHLCBREWTMQSKSD-UHFFFAOYSA-N
XLogP2.74
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-sulfamoylphenyl)naphthalene-1-carboxamide?
The IUPAC name of N-(4-sulfamoylphenyl)naphthalene-1-carboxamide (CID 788220) is N-(4-sulfamoylphenyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(4-sulfamoylphenyl)naphthalene-1-carboxamide?
The canonical SMILES for N-(4-sulfamoylphenyl)naphthalene-1-carboxamide is NS(=O)(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1.
What is the InChIKey of N-(4-sulfamoylphenyl)naphthalene-1-carboxamide?
The InChIKey is HLCBREWTMQSKSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O3S/c18-23(21,22)14-10-8-13(9-11-14)19-17(20)16-7-3-5-12-4-1-2-6-15(12)16/h1-11H,(H,19,20)(H2,18,21,22).
What are the key properties of N-(4-sulfamoylphenyl)naphthalene-1-carboxamide?
N-(4-sulfamoylphenyl)naphthalene-1-carboxamide has a molecular weight of 326.38 g/mol, XLogP of 2.74, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-sulfamoylphenyl)naphthalene-1-carboxamide is sourced from PubChem (CID 788220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).