2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide

C21H22N2O3S — CID 3485774

IUPAC2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide
SMILESCCN(CC(=O)Nc1ccccc1C)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C21H22N2O3S/c1-3-23(15-21(24)22-20-11-7-4-8-16(20)2)27(25,26)19-13-12-17-9-5-6-10-18(17)14-19/h4-14H,3,15H2,1-2H3,(H,22,24)
InChIKeyYCDPUHYXBZRULF-UHFFFAOYSA-N
MW382.49 g/mol
LogP3.80
Rot. Bonds6

About 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide

2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide (PubChem CID 3485774) has the molecular formula C21H22N2O3S and a molecular weight of 382.49 g/mol. Its IUPAC name is 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide
PubChem CID3485774
Molecular FormulaC21H22N2O3S
Molecular Weight382.49 g/mol
Exact Mass382.14
IUPAC Name2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide
SMILESCCN(CC(=O)Nc1ccccc1C)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C21H22N2O3S/c1-3-23(15-21(24)22-20-11-7-4-8-16(20)2)27(25,26)19-13-12-17-9-5-6-10-18(17)14-19/h4-14H,3,15H2,1-2H3,(H,22,24)
InChIKeyYCDPUHYXBZRULF-UHFFFAOYSA-N
XLogP3.80
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.49
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 2980569
N-(2,3-dimethylphenyl)-2-[2-methoxyethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 24678241
N-(3-bromophenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 2234331
N-(4-ethoxyphenyl)-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 1243481
ethyl 4-[[2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetyl]amino]benzoate
CID 2217901
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-[(2S)-pentan-2-yl]acetamide
CID 92518793
N-(2,4-dimethylphenyl)-2-[ethyl-(4-methylphenyl)sulfonylamino]acetamide
CID 3955899
2-[benzenesulfonyl(ethyl)amino]-N-(2-methyl-5-nitrophenyl)acetamide
CID 2231731
2-[4-(diethylsulfamoyl)anilino]-N-naphthalen-2-ylacetamide
CID 9084099
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[ethyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 45375647
2-[ethyl-(4-fluorophenyl)sulfonylamino]-N-(5-fluoro-2-methylphenyl)acetamide
CID 28547972
2-[ethyl-(4-methoxyphenyl)sulfonylamino]-N-(2-fluorophenyl)acetamide
CID 2985166

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide (CID 3485774) is 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide is CCN(CC(=O)Nc1ccccc1C)S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide?
The InChIKey is YCDPUHYXBZRULF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2O3S/c1-3-23(15-21(24)22-20-11-7-4-8-16(20)2)27(25,26)19-13-12-17-9-5-6-10-18(17)14-19/h4-14H,3,15H2,1-2H3,(H,22,24).
What are the key properties of 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide?
2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide has a molecular weight of 382.49 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(naphthalen-2-ylsulfonyl)amino]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 3485774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).