2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide

C11H15N3O4S — CID 60849783

IUPAC2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide
SMILESCS(=O)(=O)c1ccccc1NC(=O)CNC(=O)CN
InChIInChI=1S/C11H15N3O4S/c1-19(17,18)9-5-3-2-4-8(9)14-11(16)7-13-10(15)6-12/h2-5H,6-7,12H2,1H3,(H,13,15)(H,14,16)
InChIKeySZIRQWHRPFHVNX-UHFFFAOYSA-N
MW285.33 g/mol
LogP-0.90
Rot. Bonds5

About 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide

2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide (PubChem CID 60849783) has the molecular formula C11H15N3O4S and a molecular weight of 285.33 g/mol. Its IUPAC name is 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide.

Molecular Properties

Compound Name2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide
PubChem CID60849783
Molecular FormulaC11H15N3O4S
Molecular Weight285.33 g/mol
Exact Mass285.08
IUPAC Name2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide
SMILESCS(=O)(=O)c1ccccc1NC(=O)CNC(=O)CN
InChIInChI=1S/C11H15N3O4S/c1-19(17,18)9-5-3-2-4-8(9)14-11(16)7-13-10(15)6-12/h2-5H,6-7,12H2,1H3,(H,13,15)(H,14,16)
InChIKeySZIRQWHRPFHVNX-UHFFFAOYSA-N
XLogP-0.90
TPSA118.36 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 5-0.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-[2-(2-methylanilino)-2-oxoethyl]acetamide
CID 60848997
2-amino-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]acetamide
CID 60848322
N-(2-methylsulfonylphenyl)-2-(prop-2-ynylamino)acetamide
CID 78912870
5-hydroxy-N-(2-methylsulfonylphenyl)pentanamide
CID 79199090
2-(3-aminophenyl)-N-(2-methylsulfonylphenyl)acetamide
CID 62499509
2-(4-methyl-2-oxo-1,3-thiazol-3-yl)-N-(2-methylsulfonylphenyl)acetamide
CID 78832417
2-amino-2-methyl-N-(2-methylsulfonylphenyl)propanamide
CID 61265607
3-amino-N-(2-sulfamoylphenyl)propanamide
CID 10705385
2-amino-N-[2-[(5-hydroxynaphthalen-1-yl)amino]-2-oxoethyl]acetamide
CID 60849261
2-amino-N-[2-(2,3-dimethyl-5-sulfamoylanilino)-2-oxoethyl]acetamide
CID 60848496
2-(aminomethyl)-3-methyl-N-(2-methylsulfonylphenyl)butanamide
CID 65225020
methyl N-(2-methylsulfonylphenyl)carbamate
CID 117062831

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide?
The IUPAC name of 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide (CID 60849783) is 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide.
What is the SMILES notation for 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide?
The canonical SMILES for 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide is CS(=O)(=O)c1ccccc1NC(=O)CNC(=O)CN.
What is the InChIKey of 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide?
The InChIKey is SZIRQWHRPFHVNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4S/c1-19(17,18)9-5-3-2-4-8(9)14-11(16)7-13-10(15)6-12/h2-5H,6-7,12H2,1H3,(H,13,15)(H,14,16).
What are the key properties of 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide?
2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide has a molecular weight of 285.33 g/mol, XLogP of -0.90, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-methylsulfonylanilino)-2-oxoethyl]acetamide is sourced from PubChem (CID 60849783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).