1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide

C19H20N2O2 — CID 51148262

IUPAC1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide
SMILESCCc1ccccc1N1CC(C(=O)Nc2ccccc2)CC1=O
InChIInChI=1S/C19H20N2O2/c1-2-14-8-6-7-11-17(14)21-13-15(12-18(21)22)19(23)20-16-9-4-3-5-10-16/h3-11,15H,2,12-13H2,1H3,(H,20,23)
InChIKeyHNZKEVIMLMFIND-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.24
Rot. Bonds4

About 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide

1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide (PubChem CID 51148262) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide
PubChem CID51148262
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide
SMILESCCc1ccccc1N1CC(C(=O)Nc2ccccc2)CC1=O
InChIInChI=1S/C19H20N2O2/c1-2-14-8-6-7-11-17(14)21-13-15(12-18(21)22)19(23)20-16-9-4-3-5-10-16/h3-11,15H,2,12-13H2,1H3,(H,20,23)
InChIKeyHNZKEVIMLMFIND-UHFFFAOYSA-N
XLogP3.24
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-N-(4-acetamidophenyl)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 7220320
(3S)-1-(2-ethylphenyl)-N-(4-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 9004578
methyl 4-[[(3R)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate
CID 26098178
N-(2,6-diethylphenyl)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 113186319
(3S)-N-(4-bromo-3,5-dimethylphenyl)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 9004590
3-[[(3R)-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate
CID 9004553
N-[4-(difluoromethylsulfanyl)phenyl]-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 112759119
N-[4-[2-(dimethylamino)-2-oxoethyl]phenyl]-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 75809403
N-[3,5-bis(trifluoromethyl)phenyl]-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 88954768
1-(4-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 3116947
1-(2-ethylphenyl)-N-[4-(morpholin-4-ylmethyl)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 112772299
N-[4-(dibutylsulfamoyl)phenyl]-1-(2-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 17120453

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide?
The IUPAC name of 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide (CID 51148262) is 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide is CCc1ccccc1N1CC(C(=O)Nc2ccccc2)CC1=O.
What is the InChIKey of 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide?
The InChIKey is HNZKEVIMLMFIND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-2-14-8-6-7-11-17(14)21-13-15(12-18(21)22)19(23)20-16-9-4-3-5-10-16/h3-11,15H,2,12-13H2,1H3,(H,20,23).
What are the key properties of 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide?
1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 51148262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).