(2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide

C15H14F2N2O3S — CID 94812462

IUPAC(2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide
SMILESC[C@@](NS(=O)(=O)c1cc(F)ccc1F)(C(N)=O)c1ccccc1
InChIInChI=1S/C15H14F2N2O3S/c1-15(14(18)20,10-5-3-2-4-6-10)19-23(21,22)13-9-11(16)7-8-12(13)17/h2-9,19H,1H3,(H2,18,20)/t15-/m0/s1
InChIKeyZFAXXAPHQYRHAM-HNNXBMFYSA-N
MW340.35 g/mol
LogP1.64
Rot. Bonds5

About (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide

(2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide (PubChem CID 94812462) has the molecular formula C15H14F2N2O3S and a molecular weight of 340.35 g/mol. Its IUPAC name is (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide.

Molecular Properties

Compound Name(2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide
PubChem CID94812462
Molecular FormulaC15H14F2N2O3S
Molecular Weight340.35 g/mol
Exact Mass340.07
IUPAC Name(2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide
SMILESC[C@@](NS(=O)(=O)c1cc(F)ccc1F)(C(N)=O)c1ccccc1
InChIInChI=1S/C15H14F2N2O3S/c1-15(14(18)20,10-5-3-2-4-6-10)19-23(21,22)13-9-11(16)7-8-12(13)17/h2-9,19H,1H3,(H2,18,20)/t15-/m0/s1
InChIKeyZFAXXAPHQYRHAM-HNNXBMFYSA-N
XLogP1.64
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2,5-difluorobenzenesulfonamide
CID 17375863
N-(1-amino-3-methylpentan-3-yl)-2,5-difluorobenzenesulfonamide
CID 106165234
(2S)-2-[(1-methylpyrazol-4-yl)sulfonylamino]-2-phenylpropanamide
CID 94809728
(2S)-2-[(2-methyl-6-nitrophenyl)sulfonylamino]-2-phenylpropanamide
CID 52501778
2-(4-chloroanilino)-2-(3-fluorophenyl)propanamide
CID 60991447
(2S)-2-(3-fluorophenyl)-2-(methylamino)propanoic acid
CID 93279972
N-[1-amino-2-(3-chlorophenyl)-1-oxopropan-2-yl]-2,4-difluorobenzamide
CID 71977399
2-(3-fluorophenyl)-2-(2,2,2-trifluoroethylamino)propanamide
CID 54892842
2,5-difluoro-N-(2-hydroxyphenyl)benzenesulfonamide
CID 43090875
2-[(2,5-difluorophenyl)sulfonylamino]benzenecarbothioamide
CID 43236177
3-[(2-fluorophenyl)sulfonylamino]-3-methylbutanamide
CID 113431409
(2S)-2-(carbamoylamino)-2-phenylpropanoic acid
CID 94456492

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide?
The IUPAC name of (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide (CID 94812462) is (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide.
What is the SMILES notation for (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide?
The canonical SMILES for (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide is C[C@@](NS(=O)(=O)c1cc(F)ccc1F)(C(N)=O)c1ccccc1.
What is the InChIKey of (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide?
The InChIKey is ZFAXXAPHQYRHAM-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H14F2N2O3S/c1-15(14(18)20,10-5-3-2-4-6-10)19-23(21,22)13-9-11(16)7-8-12(13)17/h2-9,19H,1H3,(H2,18,20)/t15-/m0/s1.
What are the key properties of (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide?
(2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide has a molecular weight of 340.35 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[(2,5-difluorophenyl)sulfonylamino]-2-phenylpropanamide is sourced from PubChem (CID 94812462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).