2-[ethyl(methylsulfonyl)amino]propanamide

C6H14N2O3S — CID 58180370

IUPAC2-[ethyl(methylsulfonyl)amino]propanamide
SMILESCCN(C(C)C(N)=O)S(C)(=O)=O
InChIInChI=1S/C6H14N2O3S/c1-4-8(12(3,10)11)5(2)6(7)9/h5H,4H2,1-3H3,(H2,7,9)
InChIKeyNZCLXQMHWXAJGM-UHFFFAOYSA-N
MW194.26 g/mol
LogP-0.86
Rot. Bonds4

About 2-[ethyl(methylsulfonyl)amino]propanamide

2-[ethyl(methylsulfonyl)amino]propanamide (PubChem CID 58180370) has the molecular formula C6H14N2O3S and a molecular weight of 194.26 g/mol. Its IUPAC name is 2-[ethyl(methylsulfonyl)amino]propanamide.

Molecular Properties

Compound Name2-[ethyl(methylsulfonyl)amino]propanamide
PubChem CID58180370
Molecular FormulaC6H14N2O3S
Molecular Weight194.26 g/mol
Exact Mass194.07
IUPAC Name2-[ethyl(methylsulfonyl)amino]propanamide
SMILESCCN(C(C)C(N)=O)S(C)(=O)=O
InChIInChI=1S/C6H14N2O3S/c1-4-8(12(3,10)11)5(2)6(7)9/h5H,4H2,1-3H3,(H2,7,9)
InChIKeyNZCLXQMHWXAJGM-UHFFFAOYSA-N
XLogP-0.86
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 5-0.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(methylsulfonyl)amino]propanamide?
The IUPAC name of 2-[ethyl(methylsulfonyl)amino]propanamide (CID 58180370) is 2-[ethyl(methylsulfonyl)amino]propanamide.
What is the SMILES notation for 2-[ethyl(methylsulfonyl)amino]propanamide?
The canonical SMILES for 2-[ethyl(methylsulfonyl)amino]propanamide is CCN(C(C)C(N)=O)S(C)(=O)=O.
What is the InChIKey of 2-[ethyl(methylsulfonyl)amino]propanamide?
The InChIKey is NZCLXQMHWXAJGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O3S/c1-4-8(12(3,10)11)5(2)6(7)9/h5H,4H2,1-3H3,(H2,7,9).
What are the key properties of 2-[ethyl(methylsulfonyl)amino]propanamide?
2-[ethyl(methylsulfonyl)amino]propanamide has a molecular weight of 194.26 g/mol, XLogP of -0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(methylsulfonyl)amino]propanamide is sourced from PubChem (CID 58180370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).