(2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide

C11H16N2O4S — CID 7393332

IUPAC(2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(C)cc1S(=O)(=O)N[C@@H](C)C(N)=O
InChIInChI=1S/C11H16N2O4S/c1-7-4-5-9(17-3)10(6-7)18(15,16)13-8(2)11(12)14/h4-6,8,13H,1-3H3,(H2,12,14)/t8-/m0/s1
InChIKeyZVNSTCFVJPITGX-QMMMGPOBSA-N
MW272.33 g/mol
LogP0.16
Rot. Bonds5

About (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide

(2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide (PubChem CID 7393332) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide.

Molecular Properties

Compound Name(2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide
PubChem CID7393332
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC Name(2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(C)cc1S(=O)(=O)N[C@@H](C)C(N)=O
InChIInChI=1S/C11H16N2O4S/c1-7-4-5-9(17-3)10(6-7)18(15,16)13-8(2)11(12)14/h4-6,8,13H,1-3H3,(H2,12,14)/t8-/m0/s1
InChIKeyZVNSTCFVJPITGX-QMMMGPOBSA-N
XLogP0.16
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 50.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]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-[(5-fluoro-2-methoxyphenyl)sulfonylamino]propanamide
CID 43890558
(2R)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]-N-(2-methylpropyl)propanamide
CID 124549238
(2R)-N-cyclopropyl-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide
CID 7393559
2-methoxy-5-methyl-N-[(2S)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]benzenesulfonamide
CID 110347501
(2S)-4-amino-2-[(2-methoxy-5-methylphenyl)sulfonylamino]-4-oxobutanoic acid
CID 61142085
4-amino-2-[(2-methoxy-5-methylphenyl)sulfonylamino]-4-oxobutanoic acid
CID 43092547
2-methoxy-N-(1-methoxypropan-2-yl)-5-methylbenzenesulfonamide
CID 6461003
(2R)-3-hydroxy-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanoic acid
CID 80751486
2-methoxy-5-methyl-N-pentan-3-ylbenzenesulfonamide
CID 8777904
2-[(2-chloro-4-methylphenyl)sulfonylamino]propanamide
CID 75841470
(2R)-N-(2,5-dichlorophenyl)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide
CID 124548996
(2R)-N-(3-chloro-4-methylphenyl)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide
CID 7376444

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide?
The IUPAC name of (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide (CID 7393332) is (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide.
What is the SMILES notation for (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide?
The canonical SMILES for (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide is COc1ccc(C)cc1S(=O)(=O)N[C@@H](C)C(N)=O.
What is the InChIKey of (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide?
The InChIKey is ZVNSTCFVJPITGX-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-7-4-5-9(17-3)10(6-7)18(15,16)13-8(2)11(12)14/h4-6,8,13H,1-3H3,(H2,12,14)/t8-/m0/s1.
What are the key properties of (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide?
(2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide has a molecular weight of 272.33 g/mol, XLogP of 0.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(2-methoxy-5-methylphenyl)sulfonylamino]propanamide is sourced from PubChem (CID 7393332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).