N-(2-fluorophenyl)-2-phenylsulfanylpropanamide

C15H14FNOS — CID 2959569

IUPACN-(2-fluorophenyl)-2-phenylsulfanylpropanamide
SMILESCC(Sc1ccccc1)C(=O)Nc1ccccc1F
InChIInChI=1S/C15H14FNOS/c1-11(19-12-7-3-2-4-8-12)15(18)17-14-10-6-5-9-13(14)16/h2-11H,1H3,(H,17,18)
InChIKeyBZAWRIJNDYWDRQ-UHFFFAOYSA-N
MW275.35 g/mol
LogP3.94
Rot. Bonds4

About N-(2-fluorophenyl)-2-phenylsulfanylpropanamide

N-(2-fluorophenyl)-2-phenylsulfanylpropanamide (PubChem CID 2959569) has the molecular formula C15H14FNOS and a molecular weight of 275.35 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-phenylsulfanylpropanamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-phenylsulfanylpropanamide
PubChem CID2959569
Molecular FormulaC15H14FNOS
Molecular Weight275.35 g/mol
Exact Mass275.08
IUPAC NameN-(2-fluorophenyl)-2-phenylsulfanylpropanamide
SMILESCC(Sc1ccccc1)C(=O)Nc1ccccc1F
InChIInChI=1S/C15H14FNOS/c1-11(19-12-7-3-2-4-8-12)15(18)17-14-10-6-5-9-13(14)16/h2-11H,1H3,(H,17,18)
InChIKeyBZAWRIJNDYWDRQ-UHFFFAOYSA-N
XLogP3.94
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-phenylsulfanylpropanoylamino)benzoic acid
CID 23990337
(2S)-2-(2-chlorophenyl)sulfanyl-N-(2-fluorophenyl)propanamide
CID 2498847
(2R)-2-(2,5-difluorophenyl)sulfanyl-N-(2-fluorophenyl)propanamide
CID 8870293
(2S)-N-(4-fluoro-2-methylphenyl)-2-phenylsulfanylpropanamide
CID 8864929
N-phenyl-2-phenylsulfanylpropanamide
CID 2889315
N-(2,3-dichlorophenyl)-2-phenylsulfanylpropanamide
CID 2955781
(2R)-N-(2-cyanophenyl)-2-phenylsulfanylpropanamide
CID 2501567
(2S)-N-(3,4-difluorophenyl)-2-phenylsulfanylpropanamide
CID 970786
2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-N-(2-fluorophenyl)propanamide
CID 17400774
(2R)-2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-N-(2-fluorophenyl)propanamide
CID 41037714
(2R)-N-(2,5-dichlorophenyl)-2-phenylsulfanylpropanamide
CID 2501549
2-amino-N-(2-fluorophenyl)propanamide
CID 24707617

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-phenylsulfanylpropanamide?
The IUPAC name of N-(2-fluorophenyl)-2-phenylsulfanylpropanamide (CID 2959569) is N-(2-fluorophenyl)-2-phenylsulfanylpropanamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-phenylsulfanylpropanamide?
The canonical SMILES for N-(2-fluorophenyl)-2-phenylsulfanylpropanamide is CC(Sc1ccccc1)C(=O)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-2-phenylsulfanylpropanamide?
The InChIKey is BZAWRIJNDYWDRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNOS/c1-11(19-12-7-3-2-4-8-12)15(18)17-14-10-6-5-9-13(14)16/h2-11H,1H3,(H,17,18).
What are the key properties of N-(2-fluorophenyl)-2-phenylsulfanylpropanamide?
N-(2-fluorophenyl)-2-phenylsulfanylpropanamide has a molecular weight of 275.35 g/mol, XLogP of 3.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-phenylsulfanylpropanamide is sourced from PubChem (CID 2959569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).