N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide

C25H22N2O3S — CID 22306554

IUPACN-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C25H22N2O3S/c1-18-7-2-5-12-24(18)27-31(29,30)22-15-13-21(14-16-22)26-25(28)17-20-10-6-9-19-8-3-4-11-23(19)20/h2-16,27H,17H2,1H3,(H,26,28)
InChIKeyNPTWJIMHKFLLFA-UHFFFAOYSA-N
MW430.53 g/mol
LogP5.13
Rot. Bonds6

About N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide

N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide (PubChem CID 22306554) has the molecular formula C25H22N2O3S and a molecular weight of 430.53 g/mol. Its IUPAC name is N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide
PubChem CID22306554
Molecular FormulaC25H22N2O3S
Molecular Weight430.53 g/mol
Exact Mass430.14
IUPAC NameN-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide
SMILESCc1ccccc1NS(=O)(=O)c1ccc(NC(=O)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C25H22N2O3S/c1-18-7-2-5-12-24(18)27-31(29,30)22-15-13-21(14-16-22)26-25(28)17-20-10-6-9-19-8-3-4-11-23(19)20/h2-16,27H,17H2,1H3,(H,26,28)
InChIKeyNPTWJIMHKFLLFA-UHFFFAOYSA-N
XLogP5.13
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.53
LogP ≤ 55.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-phenylacetamide
CID 22306588
2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 1243916
2-[(2-methylphenyl)methylsulfanyl]-N-[4-(naphthalen-1-ylsulfamoyl)phenyl]acetamide
CID 1278407
2-(4-methoxyphenyl)-N-[4-(naphthalen-1-ylsulfamoyl)phenyl]acetamide
CID 38011386
N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228165
methyl N-[4-(naphthalen-1-ylsulfamoyl)phenyl]carbamate
CID 1149220
1-(4-methoxyphenyl)-3-[4-[(2-methylphenyl)sulfamoyl]phenyl]urea
CID 1405682
N-[4-[(2-ethylphenyl)sulfamoyl]phenyl]-2-methylbenzamide
CID 22306495
2-naphthalen-1-yl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 38175338
(2S)-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-2-yloxybutanamide
CID 28636606
N-[4-(benzylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide
CID 17145886
4-(benzenesulfonamido)-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]benzamide
CID 17052595

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide?
The IUPAC name of N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide (CID 22306554) is N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide is Cc1ccccc1NS(=O)(=O)c1ccc(NC(=O)Cc2cccc3ccccc23)cc1.
What is the InChIKey of N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide?
The InChIKey is NPTWJIMHKFLLFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H22N2O3S/c1-18-7-2-5-12-24(18)27-31(29,30)22-15-13-21(14-16-22)26-25(28)17-20-10-6-9-19-8-3-4-11-23(19)20/h2-16,27H,17H2,1H3,(H,26,28).
What are the key properties of N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide?
N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide has a molecular weight of 430.53 g/mol, XLogP of 5.13, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 22306554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).