(2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide

C15H13ClF2N2O3S — CID 1263361

IUPAC(2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
SMILESC[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C15H13ClF2N2O3S/c1-9(15(21)19-11-4-7-14(18)13(16)8-11)20-24(22,23)12-5-2-10(17)3-6-12/h2-9,20H,1H3,(H,19,21)/t9-/m1/s1
InChIKeyCCXVTTKVEZERRO-SECBINFHSA-N
MW374.80 g/mol
LogP2.92
Rot. Bonds5

About (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide

(2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide (PubChem CID 1263361) has the molecular formula C15H13ClF2N2O3S and a molecular weight of 374.80 g/mol. Its IUPAC name is (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide.

Molecular Properties

Compound Name(2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
PubChem CID1263361
Molecular FormulaC15H13ClF2N2O3S
Molecular Weight374.80 g/mol
Exact Mass374.03
IUPAC Name(2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
SMILESC[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(F)c(Cl)c1
InChIInChI=1S/C15H13ClF2N2O3S/c1-9(15(21)19-11-4-7-14(18)13(16)8-11)20-24(22,23)12-5-2-10(17)3-6-12/h2-9,20H,1H3,(H,19,21)/t9-/m1/s1
InChIKeyCCXVTTKVEZERRO-SECBINFHSA-N
XLogP2.92
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.80
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[(4-bromophenyl)sulfonylamino]-N-(3-chloro-4-fluorophenyl)propanamide
CID 41168290
(2S)-N-(4-chlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
CID 9068716
(2S)-N-(2,4-dichlorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
CID 7366747
(2S)-2-[(4-chlorophenyl)sulfonylamino]-N-(3-fluoro-4-methylphenyl)propanamide
CID 41260416
(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)propanamide
CID 124549106
2-[(4-fluorophenyl)sulfonylamino]-N-(4-propan-2-ylphenyl)propanamide
CID 4539824
(2R)-2-[(4-chlorophenyl)sulfonylamino]-N-(2,5-difluorophenyl)propanamide
CID 28549159
(2R)-N-(3-chloro-4-fluorophenyl)-2-[(2,5-dimethylphenyl)sulfonylamino]propanamide
CID 984233
(2S)-N-(4-acetamidophenyl)-2-[(4-chlorophenyl)sulfonylamino]propanamide
CID 2100165
(2S)-N-(2,4-difluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide
CID 7924414
2-(3-chloro-4-fluoroanilino)-N-(4-sulfamoylphenyl)propanamide
CID 42912001
(2R)-N-(4-fluorophenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 124548460

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide?
The IUPAC name of (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide (CID 1263361) is (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide.
What is the SMILES notation for (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide?
The canonical SMILES for (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide is C[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(F)c(Cl)c1.
What is the InChIKey of (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide?
The InChIKey is CCXVTTKVEZERRO-SECBINFHSA-N. The full InChI is InChI=1S/C15H13ClF2N2O3S/c1-9(15(21)19-11-4-7-14(18)13(16)8-11)20-24(22,23)12-5-2-10(17)3-6-12/h2-9,20H,1H3,(H,19,21)/t9-/m1/s1.
What are the key properties of (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide?
(2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide has a molecular weight of 374.80 g/mol, XLogP of 2.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(3-chloro-4-fluorophenyl)-2-[(4-fluorophenyl)sulfonylamino]propanamide is sourced from PubChem (CID 1263361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).