N-cyclopentyl-2-phenacylsulfanylacetamide

C15H19NO2S — CID 126798493

IUPACN-cyclopentyl-2-phenacylsulfanylacetamide
SMILESO=C(CSCC(=O)c1ccccc1)NC1CCCC1
InChIInChI=1S/C15H19NO2S/c17-14(12-6-2-1-3-7-12)10-19-11-15(18)16-13-8-4-5-9-13/h1-3,6-7,13H,4-5,8-11H2,(H,16,18)
InChIKeyRCSSCTVJILDDQA-UHFFFAOYSA-N
MW277.39 g/mol
LogP2.66
Rot. Bonds6

About N-cyclopentyl-2-phenacylsulfanylacetamide

N-cyclopentyl-2-phenacylsulfanylacetamide (PubChem CID 126798493) has the molecular formula C15H19NO2S and a molecular weight of 277.39 g/mol. Its IUPAC name is N-cyclopentyl-2-phenacylsulfanylacetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-phenacylsulfanylacetamide
PubChem CID126798493
Molecular FormulaC15H19NO2S
Molecular Weight277.39 g/mol
Exact Mass277.11
IUPAC NameN-cyclopentyl-2-phenacylsulfanylacetamide
SMILESO=C(CSCC(=O)c1ccccc1)NC1CCCC1
InChIInChI=1S/C15H19NO2S/c17-14(12-6-2-1-3-7-12)10-19-11-15(18)16-13-8-4-5-9-13/h1-3,6-7,13H,4-5,8-11H2,(H,16,18)
InChIKeyRCSSCTVJILDDQA-UHFFFAOYSA-N
XLogP2.66
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-phenacylsulfanylacetyl)amino]cyclohexane-1-carboxylic acid
CID 119230024
N-cyclooctyl-5-oxo-5-phenylpentanamide
CID 20969095
N-[3-(cyclopentylamino)-3-oxopropyl]-4-oxo-4-phenylbutanamide
CID 26721985
2-phenacylsulfanyl-N-phenylacetamide
CID 569693
N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876
N-(1-methylpiperidin-4-yl)-3-oxo-3-phenylpropanamide
CID 110463372
N-cyclohexyl-2-[2-(2-methoxyanilino)-2-oxoethyl]sulfanylacetamide
CID 40588524
2-(2-chlorophenyl)sulfanyl-N-cyclopentylacetamide
CID 60624624
2-[(2-chloro-6-fluorophenyl)methylsulfanyl]-N-cyclohexylacetamide
CID 967744
2-(benzylamino)-N-cyclohexylacetamide
CID 19163991
2-[2-(cyclooctylamino)-2-oxoethyl]sulfanyl-N-cyclopentylbenzamide
CID 9214809
N-cyclohexyl-2-oxo-2-phenylacetamide
CID 11436176

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-phenacylsulfanylacetamide?
The IUPAC name of N-cyclopentyl-2-phenacylsulfanylacetamide (CID 126798493) is N-cyclopentyl-2-phenacylsulfanylacetamide.
What is the SMILES notation for N-cyclopentyl-2-phenacylsulfanylacetamide?
The canonical SMILES for N-cyclopentyl-2-phenacylsulfanylacetamide is O=C(CSCC(=O)c1ccccc1)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-phenacylsulfanylacetamide?
The InChIKey is RCSSCTVJILDDQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2S/c17-14(12-6-2-1-3-7-12)10-19-11-15(18)16-13-8-4-5-9-13/h1-3,6-7,13H,4-5,8-11H2,(H,16,18).
What are the key properties of N-cyclopentyl-2-phenacylsulfanylacetamide?
N-cyclopentyl-2-phenacylsulfanylacetamide has a molecular weight of 277.39 g/mol, XLogP of 2.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-phenacylsulfanylacetamide is sourced from PubChem (CID 126798493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).