N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide

C13H15N3O3S — CID 27196270

IUPACN-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide
SMILESCC(=O)Nc1ccc(SCC(=O)N2CCNC2=O)cc1
InChIInChI=1S/C13H15N3O3S/c1-9(17)15-10-2-4-11(5-3-10)20-8-12(18)16-7-6-14-13(16)19/h2-5H,6-8H2,1H3,(H,14,19)(H,15,17)
InChIKeyNNRSYALWRPCWNH-UHFFFAOYSA-N
MW293.35 g/mol
LogP1.29
Rot. Bonds4

About N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide

N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide (PubChem CID 27196270) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide
PubChem CID27196270
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC NameN-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide
SMILESCC(=O)Nc1ccc(SCC(=O)N2CCNC2=O)cc1
InChIInChI=1S/C13H15N3O3S/c1-9(17)15-10-2-4-11(5-3-10)20-8-12(18)16-7-6-14-13(16)19/h2-5H,6-8H2,1H3,(H,14,19)(H,15,17)
InChIKeyNNRSYALWRPCWNH-UHFFFAOYSA-N
XLogP1.29
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-aminophenyl)sulfanylacetyl]imidazolidin-2-one
CID 43299355
N-[4-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]sulfanylphenyl]acetamide
CID 8819417
N-[4-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-2-oxoethyl]sulfanylphenyl]acetamide
CID 2421922
1-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfanyl)acetyl]imidazolidin-2-one
CID 7652588
potassium 2-(4-acetamidophenyl)sulfanylacetate
CID 23700024
N-[3-[3-cyclopropyl-5-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanyl-1,2,4-triazol-4-yl]phenyl]acetamide
CID 33373122
N-[4-[2-(5-nitro-2,3-dihydroindol-1-yl)-2-oxoethyl]sulfanylphenyl]acetamide
CID 27355024
2-(4-acetamidophenyl)sulfanyl-N-ethylacetamide
CID 35964472
2-(4-acetamidophenyl)sulfanyl-N-(4-methylsulfanylphenyl)acetamide
CID 42154208
2-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanyl-1H-pyrimidin-6-one
CID 9143622
[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl] 2-naphthalen-2-ylsulfanylacetate
CID 7795699
N-(4-acetamidophenyl)-2-pyridin-4-ylsulfanylacetamide
CID 51160435

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide?
The IUPAC name of N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide (CID 27196270) is N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide.
What is the SMILES notation for N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide?
The canonical SMILES for N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide is CC(=O)Nc1ccc(SCC(=O)N2CCNC2=O)cc1.
What is the InChIKey of N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide?
The InChIKey is NNRSYALWRPCWNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c1-9(17)15-10-2-4-11(5-3-10)20-8-12(18)16-7-6-14-13(16)19/h2-5H,6-8H2,1H3,(H,14,19)(H,15,17).
What are the key properties of N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide?
N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide has a molecular weight of 293.35 g/mol, XLogP of 1.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-oxo-2-(2-oxoimidazolidin-1-yl)ethyl]sulfanylphenyl]acetamide is sourced from PubChem (CID 27196270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).