N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide

C18H18N2O2S — CID 95231923

IUPACN-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S[C@H]2CCN(c3ccccc3)C2=O)cc1
InChIInChI=1S/C18H18N2O2S/c1-13(21)19-14-7-9-16(10-8-14)23-17-11-12-20(18(17)22)15-5-3-2-4-6-15/h2-10,17H,11-12H2,1H3,(H,19,21)/t17-/m0/s1
InChIKeyLOJKXYFDOOVCRE-KRWDZBQOSA-N
MW326.42 g/mol
LogP3.54
Rot. Bonds4

About N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide

N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide (PubChem CID 95231923) has the molecular formula C18H18N2O2S and a molecular weight of 326.42 g/mol. Its IUPAC name is N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide
PubChem CID95231923
Molecular FormulaC18H18N2O2S
Molecular Weight326.42 g/mol
Exact Mass326.11
IUPAC NameN-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide
SMILESCC(=O)Nc1ccc(S[C@H]2CCN(c3ccccc3)C2=O)cc1
InChIInChI=1S/C18H18N2O2S/c1-13(21)19-14-7-9-16(10-8-14)23-17-11-12-20(18(17)22)15-5-3-2-4-6-15/h2-10,17H,11-12H2,1H3,(H,19,21)/t17-/m0/s1
InChIKeyLOJKXYFDOOVCRE-KRWDZBQOSA-N
XLogP3.54
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(3-bromo-2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 63787703
N-[4-[3-(4-acetamidophenyl)sulfanyl-2,5-dioxopyrrolidin-1-yl]phenyl]acetamide
CID 19630691
N-[4-[[(6R)-5-oxo-6,7,8,9-tetrahydrobenzo[7]annulen-6-yl]sulfanyl]phenyl]acetamide
CID 95187812
N-[3-[3-cyclopropyl-5-(2-oxo-1-phenylpiperidin-3-yl)sulfanyl-1,2,4-triazol-4-yl]phenyl]acetamide
CID 86953937
1-(4-fluorophenyl)-3-phenylsulfanylazepan-2-one
CID 123301583
3-[methyl-(2-oxo-1-phenylpyrrolidin-3-yl)amino]propanoic acid
CID 119958678
1-methyl-1-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]-3-pyridin-4-ylurea
CID 95980251
3-(3H-indol-2-ylsulfanyl)-1-phenylpyrrolidin-2-one
CID 102557886
3-(3-hydroxy-2-methylpropyl)sulfanyl-1-phenylpyrrolidin-2-one
CID 111542573
2-[[4-[(3S)-1-(4-iodophenyl)-2,5-dioxopyrrolidin-3-yl]sulfanylphenyl]carbamoyl]benzoic acid
CID 99122418
N-[4-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanylphenyl]-4-methoxybenzamide
CID 22779670
N-[4-(2,5-dioxo-1-phenylpyrrolidin-3-yl)sulfanylphenyl]-3-methylbenzamide
CID 22776655

Frequently Asked Questions

What is the IUPAC name of N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide?
The IUPAC name of N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide (CID 95231923) is N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide.
What is the SMILES notation for N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide?
The canonical SMILES for N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide is CC(=O)Nc1ccc(S[C@H]2CCN(c3ccccc3)C2=O)cc1.
What is the InChIKey of N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide?
The InChIKey is LOJKXYFDOOVCRE-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H18N2O2S/c1-13(21)19-14-7-9-16(10-8-14)23-17-11-12-20(18(17)22)15-5-3-2-4-6-15/h2-10,17H,11-12H2,1H3,(H,19,21)/t17-/m0/s1.
What are the key properties of N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide?
N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide has a molecular weight of 326.42 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(3S)-2-oxo-1-phenylpyrrolidin-3-yl]sulfanylphenyl]acetamide is sourced from PubChem (CID 95231923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).