2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide

C6H13NO4S — CID 129013536

IUPAC2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide
SMILESCNC(=O)C(C)(O)CS(C)(=O)=O
InChIInChI=1S/C6H13NO4S/c1-6(9,5(8)7-2)4-12(3,10)11/h9H,4H2,1-3H3,(H,7,8)
InChIKeyRKAIBZWGTKDKFC-UHFFFAOYSA-N
MW195.24 g/mol
LogP-1.47
Rot. Bonds3

About 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide

2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide (PubChem CID 129013536) has the molecular formula C6H13NO4S and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide.

Molecular Properties

Compound Name2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide
PubChem CID129013536
Molecular FormulaC6H13NO4S
Molecular Weight195.24 g/mol
Exact Mass195.06
IUPAC Name2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide
SMILESCNC(=O)C(C)(O)CS(C)(=O)=O
InChIInChI=1S/C6H13NO4S/c1-6(9,5(8)7-2)4-12(3,10)11/h9H,4H2,1-3H3,(H,7,8)
InChIKeyRKAIBZWGTKDKFC-UHFFFAOYSA-N
XLogP-1.47
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 5-1.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide 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

(2R)-2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide
CID 129013537
2-hydroxy-2-methyl-N-propan-2-yl-3-propan-2-ylsulfonylpropanamide
CID 177122851
2-hydroxy-2-methyl-3-methylsulfonyl-N-propan-2-ylpropanamide
CID 177122893
N-(2-hydroxy-2-methylpropyl)-3-methylsulfonylpropanamide
CID 65109700
N-(2-hydroxy-2-methylpropyl)-2-methylsulfonylacetamide
CID 65110399
2-hydroxy-2-methyl-N-(2-methylsulfonylethyl)propanamide
CID 103429570
2-hydroxy-2-methyl-N-(3-methylsulfonylpropyl)propanamide
CID 103429821
2-hydroxy-2-methyl-N-(1-methylsulfonylpropan-2-yl)propanamide
CID 103430112
2-hydroxy-2-methyl-N-(2-methyl-2-methylsulfonylpropyl)propanamide
CID 103430200
2-hydroxy-2-methyl-N-(2-methylsulfinylethyl)propanamide
CID 103430459
N-(2-hydroxy-2-methyl-3-methylsulfanylpropyl)-3-methylsulfonylpropanamide
CID 103711874
N-(2-ethylsulfonylethyl)-2-hydroxy-2-methylpropanamide
CID 104936925

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide?
The IUPAC name of 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide (CID 129013536) is 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide.
What is the SMILES notation for 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide?
The canonical SMILES for 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide is CNC(=O)C(C)(O)CS(C)(=O)=O.
What is the InChIKey of 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide?
The InChIKey is RKAIBZWGTKDKFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO4S/c1-6(9,5(8)7-2)4-12(3,10)11/h9H,4H2,1-3H3,(H,7,8).
What are the key properties of 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide?
2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide has a molecular weight of 195.24 g/mol, XLogP of -1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N,2-dimethyl-3-methylsulfonylpropanamide is sourced from PubChem (CID 129013536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).