N-methyl-2-(2-methylsulfonylethylamino)propanamide

C7H16N2O3S — CID 60918919

IUPACN-methyl-2-(2-methylsulfonylethylamino)propanamide
SMILESCNC(=O)C(C)NCCS(C)(=O)=O
InChIInChI=1S/C7H16N2O3S/c1-6(7(10)8-2)9-4-5-13(3,11)12/h6,9H,4-5H2,1-3H3,(H,8,10)
InChIKeyWIEUAAQTPKIJDO-UHFFFAOYSA-N
MW208.28 g/mol
LogP-1.24
Rot. Bonds5

About N-methyl-2-(2-methylsulfonylethylamino)propanamide

N-methyl-2-(2-methylsulfonylethylamino)propanamide (PubChem CID 60918919) has the molecular formula C7H16N2O3S and a molecular weight of 208.28 g/mol. Its IUPAC name is N-methyl-2-(2-methylsulfonylethylamino)propanamide.

Molecular Properties

Compound NameN-methyl-2-(2-methylsulfonylethylamino)propanamide
PubChem CID60918919
Molecular FormulaC7H16N2O3S
Molecular Weight208.28 g/mol
Exact Mass208.09
IUPAC NameN-methyl-2-(2-methylsulfonylethylamino)propanamide
SMILESCNC(=O)C(C)NCCS(C)(=O)=O
InChIInChI=1S/C7H16N2O3S/c1-6(7(10)8-2)9-4-5-13(3,11)12/h6,9H,4-5H2,1-3H3,(H,8,10)
InChIKeyWIEUAAQTPKIJDO-UHFFFAOYSA-N
XLogP-1.24
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.28
LogP ≤ 5-1.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-(2-methylsulfonylethylamino)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-ethylsulfonylethylamino)-N-methylpropanamide
CID 61464372
N-methyl-2-(2-sulfamoylethylamino)propanamide
CID 114384925
N,N-dimethyl-2-(2-methylsulfonylethylamino)propanamide
CID 60919155
N-(2-methylsulfonylethyl)propan-2-amine
CID 60708370
ethane;N-(2-methylsulfonylethyl)propan-2-amine
CID 142531419
ethyl 3-[[1-(methylamino)-1-oxopropan-2-yl]amino]propanoate
CID 61464453
2-(2-cyclopentylethylamino)-N-methylpropanamide
CID 60919372
3-methoxy-2-(2-methylsulfonylethylamino)propanoic acid
CID 103240234
4-methyl-N-(2-methylsulfonylethyl)pentan-2-amine
CID 60920037
N-methyl-2-(prop-2-ynylamino)propanamide
CID 43086395
(2R)-2-N-(2-methylsulfonylethyl)propane-1,2-diamine
CID 104867919
3-methyl-N-(2-methylsulfonylethyl)-2-sulfanylbutanamide
CID 107023632

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylsulfonylethylamino)propanamide?
The IUPAC name of N-methyl-2-(2-methylsulfonylethylamino)propanamide (CID 60918919) is N-methyl-2-(2-methylsulfonylethylamino)propanamide.
What is the SMILES notation for N-methyl-2-(2-methylsulfonylethylamino)propanamide?
The canonical SMILES for N-methyl-2-(2-methylsulfonylethylamino)propanamide is CNC(=O)C(C)NCCS(C)(=O)=O.
What is the InChIKey of N-methyl-2-(2-methylsulfonylethylamino)propanamide?
The InChIKey is WIEUAAQTPKIJDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O3S/c1-6(7(10)8-2)9-4-5-13(3,11)12/h6,9H,4-5H2,1-3H3,(H,8,10).
What are the key properties of N-methyl-2-(2-methylsulfonylethylamino)propanamide?
N-methyl-2-(2-methylsulfonylethylamino)propanamide has a molecular weight of 208.28 g/mol, XLogP of -1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylsulfonylethylamino)propanamide is sourced from PubChem (CID 60918919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).