N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide

C19H20N2O2S — CID 26955397

IUPACN-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide
SMILESO=C(CCSc1ccccc1)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C19H20N2O2S/c22-18(12-14-24-15-7-2-1-3-8-15)20-16-9-4-5-10-17(16)21-13-6-11-19(21)23/h1-5,7-10H,6,11-14H2,(H,20,22)
InChIKeyUQCBAMKTKVKSOA-UHFFFAOYSA-N
MW340.45 g/mol
LogP3.93
Rot. Bonds6

About N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide

N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide (PubChem CID 26955397) has the molecular formula C19H20N2O2S and a molecular weight of 340.45 g/mol. Its IUPAC name is N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide.

Molecular Properties

Compound NameN-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide
PubChem CID26955397
Molecular FormulaC19H20N2O2S
Molecular Weight340.45 g/mol
Exact Mass340.12
IUPAC NameN-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide
SMILESO=C(CCSc1ccccc1)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C19H20N2O2S/c22-18(12-14-24-15-7-2-1-3-8-15)20-16-9-4-5-10-17(16)21-13-6-11-19(21)23/h1-5,7-10H,6,11-14H2,(H,20,22)
InChIKeyUQCBAMKTKVKSOA-UHFFFAOYSA-N
XLogP3.93
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-[2-(2-oxopyrrolidin-1-yl)phenyl]pentanamide
CID 107909776
2-cyclopentyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 51228887
N-[2-(2-oxopyrrolidin-1-yl)phenyl]-2-phenoxyacetamide
CID 17462839
2-(methylamino)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide;hydrochloride
CID 119693883
3-(2-ethoxyphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 26955412
2-(4-hydroxypiperidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 41335965
2-(2-aminoethoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 79473885
1-[2-oxo-2-[2-(2-oxopyrrolidin-1-yl)anilino]ethyl]pyrrolidine-2-carboxylic acid
CID 119909357
N-[2-(2-oxopyrrolidin-1-yl)phenyl]-2-[(2S)-2-phenylpyrrolidin-1-yl]acetamide
CID 41359869
2-(2-benzylpyrrolidin-1-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 51339357
2-(2,3-dihydro-1H-inden-5-yl)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 26955686
N-[2-(2-oxopyrrolidin-1-yl)phenyl]cyclopropanecarboxamide
CID 18166596

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide?
The IUPAC name of N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide (CID 26955397) is N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide.
What is the SMILES notation for N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide?
The canonical SMILES for N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide is O=C(CCSc1ccccc1)Nc1ccccc1N1CCCC1=O.
What is the InChIKey of N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide?
The InChIKey is UQCBAMKTKVKSOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2S/c22-18(12-14-24-15-7-2-1-3-8-15)20-16-9-4-5-10-17(16)21-13-6-11-19(21)23/h1-5,7-10H,6,11-14H2,(H,20,22).
What are the key properties of N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide?
N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide has a molecular weight of 340.45 g/mol, XLogP of 3.93, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxopyrrolidin-1-yl)phenyl]-3-phenylsulfanylpropanamide is sourced from PubChem (CID 26955397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).