N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide

C19H20FNOS — CID 32558856

IUPACN-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1ccccc1SC1CCCC1
InChIInChI=1S/C19H20FNOS/c20-15-7-5-6-14(12-15)13-19(22)21-17-10-3-4-11-18(17)23-16-8-1-2-9-16/h3-7,10-12,16H,1-2,8-9,13H2,(H,21,22)
InChIKeyJIHFLIZZUXKUEM-UHFFFAOYSA-N
MW329.44 g/mol
LogP5.04
Rot. Bonds5

About N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide

N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide (PubChem CID 32558856) has the molecular formula C19H20FNOS and a molecular weight of 329.44 g/mol. Its IUPAC name is N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide
PubChem CID32558856
Molecular FormulaC19H20FNOS
Molecular Weight329.44 g/mol
Exact Mass329.12
IUPAC NameN-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide
SMILESO=C(Cc1cccc(F)c1)Nc1ccccc1SC1CCCC1
InChIInChI=1S/C19H20FNOS/c20-15-7-5-6-14(12-15)13-19(22)21-17-10-3-4-11-18(17)23-16-8-1-2-9-16/h3-7,10-12,16H,1-2,8-9,13H2,(H,21,22)
InChIKeyJIHFLIZZUXKUEM-UHFFFAOYSA-N
XLogP5.04
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500329.44
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyclopentylsulfanylphenyl)-2-(propan-2-ylamino)acetamide
CID 60843241
5-chloro-N-(2-cyclopentylsulfanylphenyl)pentanamide
CID 43696000
N-(2-cyclopentylsulfanylphenyl)-4-(methylamino)butanamide
CID 60841702
2-(3-fluorophenyl)-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]acetamide
CID 38763351
N-(2-cyclopentylsulfanylphenyl)-5-fluoro-2-methoxybenzamide
CID 55615222
2-(3-fluorophenyl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 26515848
3-amino-N-(2-cyclopentylsulfanylphenyl)-3-phenylpropanamide;hydrochloride
CID 119950014
N-(2-cyclopentylsulfanylphenyl)-2-[3,5-dimethyl-1-(2-methylpropyl)pyrazol-4-yl]acetamide
CID 32559945
2-(3-fluorophenyl)-N-(3-hydroxy-2-methylphenyl)acetamide
CID 64793447
N-[6-(cyclopentylamino)pyridazin-3-yl]-2-(3-fluorophenyl)acetamide
CID 113038874
2-(3-fluorophenyl)-N-[2-(trifluoromethoxy)phenyl]acetamide
CID 24525372
N-(2-cyclopentylsulfanylphenyl)-2-methylsulfanylpropanamide
CID 47327417

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide?
The IUPAC name of N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide (CID 32558856) is N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide.
What is the SMILES notation for N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide?
The canonical SMILES for N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide is O=C(Cc1cccc(F)c1)Nc1ccccc1SC1CCCC1.
What is the InChIKey of N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide?
The InChIKey is JIHFLIZZUXKUEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNOS/c20-15-7-5-6-14(12-15)13-19(22)21-17-10-3-4-11-18(17)23-16-8-1-2-9-16/h3-7,10-12,16H,1-2,8-9,13H2,(H,21,22).
What are the key properties of N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide?
N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide has a molecular weight of 329.44 g/mol, XLogP of 5.04, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylsulfanylphenyl)-2-(3-fluorophenyl)acetamide is sourced from PubChem (CID 32558856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).