(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide

C16H17FN2O3S — CID 28540532

IUPAC(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide
SMILESCNC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C16H17FN2O3S/c1-18-16(20)15(11-12-5-3-2-4-6-12)19-23(21,22)14-9-7-13(17)8-10-14/h2-10,15,19H,11H2,1H3,(H,18,20)/t15-/m1/s1
InChIKeyIKNQZPFSDFPZHX-OAHLLOKOSA-N
MW336.39 g/mol
LogP1.46
Rot. Bonds6

About (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide

(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide (PubChem CID 28540532) has the molecular formula C16H17FN2O3S and a molecular weight of 336.39 g/mol. Its IUPAC name is (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide.

Molecular Properties

Compound Name(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide
PubChem CID28540532
Molecular FormulaC16H17FN2O3S
Molecular Weight336.39 g/mol
Exact Mass336.09
IUPAC Name(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide
SMILESCNC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C16H17FN2O3S/c1-18-16(20)15(11-12-5-3-2-4-6-12)19-23(21,22)14-9-7-13(17)8-10-14/h2-10,15,19H,11H2,1H3,(H,18,20)/t15-/m1/s1
InChIKeyIKNQZPFSDFPZHX-OAHLLOKOSA-N
XLogP1.46
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.39
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-N-(4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]-3-phenylpropanamide
CID 28540814
(2S)-N-(4-fluorophenyl)-2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide
CID 1208444
(2S)-2-[(4-fluorophenyl)sulfonylamino]-N-(2-methylpropyl)-3-phenylpropanamide
CID 28540557
(2R)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]-3-phenylpropanamide
CID 28540829
sodium (2S)-2-[(4-fluorophenyl)sulfonylamino]-3-phenylpropanoate
CID 139844001
(2S)-N-(3,4-difluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]-3-phenylpropanamide
CID 28541415
(2S)-2-[(4-fluorophenyl)sulfonylamino]-N-(2-methylphenyl)-3-phenylpropanamide
CID 28540720
(2S)-N-(3-acetylphenyl)-2-[(4-fluorophenyl)sulfonylamino]-3-phenylpropanamide
CID 28541081
4-[[(2S)-2-[(4-fluorophenyl)sulfonylamino]-3-phenylpropanoyl]amino]benzamide
CID 28541065
2-[(4-fluorophenyl)sulfonylamino]-N-heptyl-3-phenylpropanamide
CID 20967531
2-[(4-fluorophenyl)sulfonylamino]-N-(1-methoxypropan-2-yl)-3-phenylpropanamide
CID 43871290
2-[(4-fluorophenyl)sulfonylamino]-N-(3-methoxypropyl)-3-phenylpropanamide
CID 43871187

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide?
The IUPAC name of (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide (CID 28540532) is (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide.
What is the SMILES notation for (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide?
The canonical SMILES for (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide is CNC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide?
The InChIKey is IKNQZPFSDFPZHX-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H17FN2O3S/c1-18-16(20)15(11-12-5-3-2-4-6-12)19-23(21,22)14-9-7-13(17)8-10-14/h2-10,15,19H,11H2,1H3,(H,18,20)/t15-/m1/s1.
What are the key properties of (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide?
(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide has a molecular weight of 336.39 g/mol, XLogP of 1.46, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[(4-fluorophenyl)sulfonylamino]-N-methyl-3-phenylpropanamide is sourced from PubChem (CID 28540532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).