(2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide

C15H11F4NOS — CID 8975147

IUPAC(2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
SMILESC[C@@H](Sc1ccc(F)cc1F)C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C15H11F4NOS/c1-8(22-14-5-3-10(17)7-12(14)19)15(21)20-13-4-2-9(16)6-11(13)18/h2-8H,1H3,(H,20,21)/t8-/m1/s1
InChIKeyLCNYNCZDTZEOAQ-MRVPVSSYSA-N
MW329.32 g/mol
LogP4.36
Rot. Bonds4

About (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide

(2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide (PubChem CID 8975147) has the molecular formula C15H11F4NOS and a molecular weight of 329.32 g/mol. Its IUPAC name is (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide.

Molecular Properties

Compound Name(2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
PubChem CID8975147
Molecular FormulaC15H11F4NOS
Molecular Weight329.32 g/mol
Exact Mass329.05
IUPAC Name(2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
SMILESC[C@@H](Sc1ccc(F)cc1F)C(=O)Nc1ccc(F)cc1F
InChIInChI=1S/C15H11F4NOS/c1-8(22-14-5-3-10(17)7-12(14)19)15(21)20-13-4-2-9(16)6-11(13)18/h2-8H,1H3,(H,20,21)/t8-/m1/s1
InChIKeyLCNYNCZDTZEOAQ-MRVPVSSYSA-N
XLogP4.36
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.32
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2,4-difluorophenyl)sulfanyl-N-(2-methoxyphenyl)propanamide
CID 9046467
(2R)-2-(4-chlorophenyl)sulfanyl-N-(2,4-difluorophenyl)propanamide
CID 887088
N-(2,4-difluorophenyl)-2-(4-methylphenyl)sulfanylpropanamide
CID 2947131
N-(2,3-dichlorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
CID 55387332
(2S)-2-(2,4-difluorophenyl)sulfanyl-N-(3-fluorophenyl)propanamide
CID 8975115
2-(4-acetamidophenyl)sulfanyl-N-(2,4-difluorophenyl)propanamide
CID 51235630
N-(4-aminophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide
CID 43345467
(2R)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-N-(2,4-difluorophenyl)propanamide
CID 8985865
(2R)-N-(2,4-difluorophenyl)-2-(4-methoxyphenyl)sulfanylpropanamide
CID 9063439
(2R)-2-(2,5-difluorophenyl)sulfanyl-N-(2-fluorophenyl)propanamide
CID 8870293
4-[[(2R)-2-(2,4-difluorophenyl)sulfanylpropanoyl]amino]benzamide
CID 9046418
(2S)-N-(2,4-difluorophenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide
CID 8890306

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide?
The IUPAC name of (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide (CID 8975147) is (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide.
What is the SMILES notation for (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide?
The canonical SMILES for (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide is C[C@@H](Sc1ccc(F)cc1F)C(=O)Nc1ccc(F)cc1F.
What is the InChIKey of (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide?
The InChIKey is LCNYNCZDTZEOAQ-MRVPVSSYSA-N. The full InChI is InChI=1S/C15H11F4NOS/c1-8(22-14-5-3-10(17)7-12(14)19)15(21)20-13-4-2-9(16)6-11(13)18/h2-8H,1H3,(H,20,21)/t8-/m1/s1.
What are the key properties of (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide?
(2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide has a molecular weight of 329.32 g/mol, XLogP of 4.36, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,4-difluorophenyl)-2-(2,4-difluorophenyl)sulfanylpropanamide is sourced from PubChem (CID 8975147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).