(2R)-2-(benzenesulfonamido)propanamide

C9H12N2O3S — CID 970705

IUPAC(2R)-2-(benzenesulfonamido)propanamide
SMILESC[C@@H](NS(=O)(=O)c1ccccc1)C(N)=O
InChIInChI=1S/C9H12N2O3S/c1-7(9(10)12)11-15(13,14)8-5-3-2-4-6-8/h2-7,11H,1H3,(H2,10,12)/t7-/m1/s1
InChIKeyLFDMXJFRWBQWOI-SSDOTTSWSA-N
MW228.27 g/mol
LogP-0.16
Rot. Bonds4

About (2R)-2-(benzenesulfonamido)propanamide

(2R)-2-(benzenesulfonamido)propanamide (PubChem CID 970705) has the molecular formula C9H12N2O3S and a molecular weight of 228.27 g/mol. Its IUPAC name is (2R)-2-(benzenesulfonamido)propanamide.

Molecular Properties

Compound Name(2R)-2-(benzenesulfonamido)propanamide
PubChem CID970705
Molecular FormulaC9H12N2O3S
Molecular Weight228.27 g/mol
Exact Mass228.06
IUPAC Name(2R)-2-(benzenesulfonamido)propanamide
SMILESC[C@@H](NS(=O)(=O)c1ccccc1)C(N)=O
InChIInChI=1S/C9H12N2O3S/c1-7(9(10)12)11-15(13,14)8-5-3-2-4-6-8/h2-7,11H,1H3,(H2,10,12)/t7-/m1/s1
InChIKeyLFDMXJFRWBQWOI-SSDOTTSWSA-N
XLogP-0.16
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.27
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2S)-2-(benzenesulfonamido)propanoate
CID 10857687
(2S)-2-[(4-sulfamoylphenyl)sulfonylamino]propanamide
CID 94501214
N-(3-oxobutan-2-yl)benzenesulfonamide
CID 64994182
N-(1-oxo-1-phenylpropan-2-yl)benzenesulfonamide
CID 13293562
(2S)-2-(benzenesulfonamido)-N-phenylpropanamide
CID 41330853
2-(benzenesulfonamido)-N-propan-2-ylpropanamide
CID 3279426
methyl (2S)-2-[(4-phenylphenyl)sulfonylamino]propanoate
CID 87040440
N-(4-acetamidophenyl)-2-(benzenesulfonamido)propanamide
CID 4240198
(2S)-2-(benzenesulfonamido)-N-benzhydrylpropanamide
CID 124596255
(2S)-2-(benzenesulfonamido)-3-methylbutanoic acid;methane
CID 158887122
(2S)-2-(benzenesulfonamido)-N-[(2R)-butan-2-yl]propanamide
CID 41330742
2-[(4-methylphenyl)sulfonylamino]-N-phenylpropanamide
CID 5205930

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(benzenesulfonamido)propanamide?
The IUPAC name of (2R)-2-(benzenesulfonamido)propanamide (CID 970705) is (2R)-2-(benzenesulfonamido)propanamide.
What is the SMILES notation for (2R)-2-(benzenesulfonamido)propanamide?
The canonical SMILES for (2R)-2-(benzenesulfonamido)propanamide is C[C@@H](NS(=O)(=O)c1ccccc1)C(N)=O.
What is the InChIKey of (2R)-2-(benzenesulfonamido)propanamide?
The InChIKey is LFDMXJFRWBQWOI-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H12N2O3S/c1-7(9(10)12)11-15(13,14)8-5-3-2-4-6-8/h2-7,11H,1H3,(H2,10,12)/t7-/m1/s1.
What are the key properties of (2R)-2-(benzenesulfonamido)propanamide?
(2R)-2-(benzenesulfonamido)propanamide has a molecular weight of 228.27 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(benzenesulfonamido)propanamide is sourced from PubChem (CID 970705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).