2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide

C21H22N2O3S — CID 1243916

IUPAC2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
SMILESCC(C)NS(=O)(=O)c1ccc(NC(=O)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C21H22N2O3S/c1-15(2)23-27(25,26)19-12-10-18(11-13-19)22-21(24)14-17-8-5-7-16-6-3-4-9-20(16)17/h3-13,15,23H,14H2,1-2H3,(H,22,24)
InChIKeyBPQGYKVXYUISDS-UHFFFAOYSA-N
MW382.49 g/mol
LogP3.71
Rot. Bonds6

About 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide

2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide (PubChem CID 1243916) has the molecular formula C21H22N2O3S and a molecular weight of 382.49 g/mol. Its IUPAC name is 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
PubChem CID1243916
Molecular FormulaC21H22N2O3S
Molecular Weight382.49 g/mol
Exact Mass382.14
IUPAC Name2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
SMILESCC(C)NS(=O)(=O)c1ccc(NC(=O)Cc2cccc3ccccc23)cc1
InChIInChI=1S/C21H22N2O3S/c1-15(2)23-27(25,26)19-12-10-18(11-13-19)22-21(24)14-17-8-5-7-16-6-3-4-9-20(16)17/h3-13,15,23H,14H2,1-2H3,(H,22,24)
InChIKeyBPQGYKVXYUISDS-UHFFFAOYSA-N
XLogP3.71
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.49
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-2-naphthalen-1-ylacetamide
CID 22306554
2-naphthalen-1-yl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 38175338
2-(4-methoxyphenyl)-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 2222071
N-[4-(butan-2-ylsulfamoyl)phenyl]-2-(2-methylphenyl)acetamide
CID 43877406
N,N'-bis[4-(propan-2-ylsulfamoyl)phenyl]nonanediamide
CID 4924725
2,2-diphenyl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 1263402
1-methyl-1-[(2-methylphenyl)methyl]-3-[4-(propan-2-ylsulfamoyl)phenyl]urea
CID 86987903
N-methyl-4-[(2-naphthalen-1-ylacetyl)amino]benzamide
CID 8700251
2-phenyl-N-[4-(propan-2-ylsulfamoyl)phenyl]butanamide
CID 17147291
2-methyl-N-[4-[(2-naphthalen-1-ylacetyl)carbamothioylamino]phenyl]propanamide
CID 17188042
5-hydroxy-N-[4-(propan-2-ylsulfamoyl)phenyl]pentanamide
CID 79194887
2-amino-N-[4-(propan-2-ylsulfamoyl)phenyl]propanamide;hydrochloride
CID 119269225

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide (CID 1243916) is 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide is CC(C)NS(=O)(=O)c1ccc(NC(=O)Cc2cccc3ccccc23)cc1.
What is the InChIKey of 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide?
The InChIKey is BPQGYKVXYUISDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O3S/c1-15(2)23-27(25,26)19-12-10-18(11-13-19)22-21(24)14-17-8-5-7-16-6-3-4-9-20(16)17/h3-13,15,23H,14H2,1-2H3,(H,22,24).
What are the key properties of 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide?
2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide has a molecular weight of 382.49 g/mol, XLogP of 3.71, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 1243916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).