2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide

C13H14N2O3S — CID 977503

IUPAC2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
SMILESCN(CC(N)=O)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C13H14N2O3S/c1-15(9-13(14)16)19(17,18)12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,9H2,1H3,(H2,14,16)
InChIKeyKZNKZYHXNPXAOI-UHFFFAOYSA-N
MW278.33 g/mol
LogP0.95
Rot. Bonds4

About 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide

2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide (PubChem CID 977503) has the molecular formula C13H14N2O3S and a molecular weight of 278.33 g/mol. Its IUPAC name is 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide.

Molecular Properties

Compound Name2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
PubChem CID977503
Molecular FormulaC13H14N2O3S
Molecular Weight278.33 g/mol
Exact Mass278.07
IUPAC Name2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
SMILESCN(CC(N)=O)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C13H14N2O3S/c1-15(9-13(14)16)19(17,18)12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,9H2,1H3,(H2,14,16)
InChIKeyKZNKZYHXNPXAOI-UHFFFAOYSA-N
XLogP0.95
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 27276320
2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-naphthalen-2-ylacetamide
CID 9403525
N-methyl-2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-[(4-methylsulfanylphenyl)methyl]acetamide
CID 134028890
N-(2,6-diethylphenyl)-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 2203258
N-benzyl-2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-propan-2-ylacetamide
CID 24609811
N-(3,5-dichlorophenyl)-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 45375147
N-(2-methoxyethyl)-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 2207014
2-[[3-(aminomethyl)phenyl]sulfonyl-methylamino]acetamide
CID 43374208
2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-(3-methylsulfanylphenyl)acetamide
CID 2202584
N-(4-ethylphenyl)-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 2202463
2-[methyl(naphthalen-2-ylsulfonyl)amino]-N-(2,4,5-trichlorophenyl)acetamide
CID 45375148
N-cyclohexyl-2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 1292427

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The IUPAC name of 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide (CID 977503) is 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide.
What is the SMILES notation for 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The canonical SMILES for 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide is CN(CC(N)=O)S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide?
The InChIKey is KZNKZYHXNPXAOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3S/c1-15(9-13(14)16)19(17,18)12-7-6-10-4-2-3-5-11(10)8-12/h2-8H,9H2,1H3,(H2,14,16).
What are the key properties of 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide?
2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide has a molecular weight of 278.33 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide is sourced from PubChem (CID 977503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).