2-[methylsulfonyl(2-phenylethyl)amino]acetamide

C11H16N2O3S — CID 963790

IUPAC2-[methylsulfonyl(2-phenylethyl)amino]acetamide
SMILESCS(=O)(=O)N(CCc1ccccc1)CC(N)=O
InChIInChI=1S/C11H16N2O3S/c1-17(15,16)13(9-11(12)14)8-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,12,14)
InChIKeyVVZHMBPCUCZNOA-UHFFFAOYSA-N
MW256.33 g/mol
LogP-0.02
Rot. Bonds6

About 2-[methylsulfonyl(2-phenylethyl)amino]acetamide

2-[methylsulfonyl(2-phenylethyl)amino]acetamide (PubChem CID 963790) has the molecular formula C11H16N2O3S and a molecular weight of 256.33 g/mol. Its IUPAC name is 2-[methylsulfonyl(2-phenylethyl)amino]acetamide.

Molecular Properties

Compound Name2-[methylsulfonyl(2-phenylethyl)amino]acetamide
PubChem CID963790
Molecular FormulaC11H16N2O3S
Molecular Weight256.33 g/mol
Exact Mass256.09
IUPAC Name2-[methylsulfonyl(2-phenylethyl)amino]acetamide
SMILESCS(=O)(=O)N(CCc1ccccc1)CC(N)=O
InChIInChI=1S/C11H16N2O3S/c1-17(15,16)13(9-11(12)14)8-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,12,14)
InChIKeyVVZHMBPCUCZNOA-UHFFFAOYSA-N
XLogP-0.02
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[methylsulfonyl(2-phenylethyl)amino]acetamide?
The IUPAC name of 2-[methylsulfonyl(2-phenylethyl)amino]acetamide (CID 963790) is 2-[methylsulfonyl(2-phenylethyl)amino]acetamide.
What is the SMILES notation for 2-[methylsulfonyl(2-phenylethyl)amino]acetamide?
The canonical SMILES for 2-[methylsulfonyl(2-phenylethyl)amino]acetamide is CS(=O)(=O)N(CCc1ccccc1)CC(N)=O.
What is the InChIKey of 2-[methylsulfonyl(2-phenylethyl)amino]acetamide?
The InChIKey is VVZHMBPCUCZNOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3S/c1-17(15,16)13(9-11(12)14)8-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,12,14).
What are the key properties of 2-[methylsulfonyl(2-phenylethyl)amino]acetamide?
2-[methylsulfonyl(2-phenylethyl)amino]acetamide has a molecular weight of 256.33 g/mol, XLogP of -0.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methylsulfonyl(2-phenylethyl)amino]acetamide is sourced from PubChem (CID 963790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).