N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide

C19H16N2O4S — CID 1221316

IUPACN-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C19H16N2O4S/c1-13(22)21-26(24,25)16-11-9-15(10-12-16)20-19(23)18-8-4-6-14-5-2-3-7-17(14)18/h2-12H,1H3,(H,20,23)(H,21,22)
InChIKeyDVVUVEQXLOVRGH-UHFFFAOYSA-N
MW368.41 g/mol
LogP2.92
Rot. Bonds4

About N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide

N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide (PubChem CID 1221316) has the molecular formula C19H16N2O4S and a molecular weight of 368.41 g/mol. Its IUPAC name is N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide
PubChem CID1221316
Molecular FormulaC19H16N2O4S
Molecular Weight368.41 g/mol
Exact Mass368.08
IUPAC NameN-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide
SMILESCC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1
InChIInChI=1S/C19H16N2O4S/c1-13(22)21-26(24,25)16-11-9-15(10-12-16)20-19(23)18-8-4-6-14-5-2-3-7-17(14)18/h2-12H,1H3,(H,20,23)(H,21,22)
InChIKeyDVVUVEQXLOVRGH-UHFFFAOYSA-N
XLogP2.92
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.41
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide?
The IUPAC name of N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide (CID 1221316) is N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide is CC(=O)NS(=O)(=O)c1ccc(NC(=O)c2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide?
The InChIKey is DVVUVEQXLOVRGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N2O4S/c1-13(22)21-26(24,25)16-11-9-15(10-12-16)20-19(23)18-8-4-6-14-5-2-3-7-17(14)18/h2-12H,1H3,(H,20,23)(H,21,22).
What are the key properties of N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide?
N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide has a molecular weight of 368.41 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(acetylsulfamoyl)phenyl]naphthalene-1-carboxamide is sourced from PubChem (CID 1221316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).