(2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide

C15H16N2O5S — CID 143175692

IUPAC(2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide
SMILESN[C@@](CO)(C(=O)NO)S(=O)(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H16N2O5S/c16-15(10-18,14(19)17-20)23(21,22)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,18,20H,10,16H2,(H,17,19)/t15-/m1/s1
InChIKeyFQXPUFPQALZBLC-OAHLLOKOSA-N
MW336.37 g/mol
LogP0.28
Rot. Bonds5

About (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide

(2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide (PubChem CID 143175692) has the molecular formula C15H16N2O5S and a molecular weight of 336.37 g/mol. Its IUPAC name is (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide
PubChem CID143175692
Molecular FormulaC15H16N2O5S
Molecular Weight336.37 g/mol
Exact Mass336.08
IUPAC Name(2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide
SMILESN[C@@](CO)(C(=O)NO)S(=O)(=O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C15H16N2O5S/c16-15(10-18,14(19)17-20)23(21,22)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,18,20H,10,16H2,(H,17,19)/t15-/m1/s1
InChIKeyFQXPUFPQALZBLC-OAHLLOKOSA-N
XLogP0.28
TPSA129.72 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.37
LogP ≤ 50.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-amino-3-hydroxy-2-[4-(trifluoromethyl)phenyl]sulfonylpropanamide
CID 154126143
N,3-dihydroxy-2-[(4-phenylphenyl)sulfonylamino]propanamide
CID 58835339
(2S,3R)-N,3-dihydroxy-2-[(4-phenylphenyl)sulfonylmethylamino]butanamide
CID 87639192
(2S)-2-amino-N,3-dihydroxy-N-(4-phenylphenyl)sulfonylpropanamide
CID 87800282
(2S)-3-hydroxy-2-[hydroxy-(4-phenylphenyl)sulfonylamino]propanamide
CID 91320908
(2S)-N,3-dihydroxy-2-[(4-phenylphenyl)sulfonylamino]propanamide
CID 91512322
(2R)-2-amino-3-hydroxy-2-(4-methylphenyl)sulfonylpropanamide
CID 143175700
(2R,3R)-2-amino-N,3-dihydroxy-2-[4-(2-methylbutan-2-yl)phenyl]sulfonylbutanamide
CID 150087759
(2R)-2-amino-N,3-dihydroxy-2-[4-(2-methylbutan-2-yl)phenyl]sulfonylpropanamide
CID 151966798
(2S)-2-amino-N-hydroxy-2-(4-phenylphenyl)sulfonyl-3-sulfanylpropanamide
CID 154070964
(2R)-2-amino-3-hydroxy-2-(4-propylphenyl)sulfonylpropanamide
CID 154152303
(2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide
CID 154155267

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide?
The IUPAC name of (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide (CID 143175692) is (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide.
What is the SMILES notation for (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide?
The canonical SMILES for (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide is N[C@@](CO)(C(=O)NO)S(=O)(=O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide?
The InChIKey is FQXPUFPQALZBLC-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H16N2O5S/c16-15(10-18,14(19)17-20)23(21,22)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h1-9,18,20H,10,16H2,(H,17,19)/t15-/m1/s1.
What are the key properties of (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide?
(2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide has a molecular weight of 336.37 g/mol, XLogP of 0.28, 5 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N,3-dihydroxy-2-(4-phenylphenyl)sulfonylpropanamide is sourced from PubChem (CID 143175692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).