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

C19H20N2O2 — CID 46687180

IUPACN-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCCc1cccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)c1
InChIInChI=1S/C19H20N2O2/c1-2-14-7-6-8-16(11-14)20-19(23)15-12-18(22)21(13-15)17-9-4-3-5-10-17/h3-11,15H,2,12-13H2,1H3,(H,20,23)
InChIKeyWNRVBVXINBTQNU-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.24
Rot. Bonds4

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

N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide (PubChem CID 46687180) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
PubChem CID46687180
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCCc1cccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)c1
InChIInChI=1S/C19H20N2O2/c1-2-14-7-6-8-16(11-14)20-19(23)15-12-18(22)21(13-15)17-9-4-3-5-10-17/h3-11,15H,2,12-13H2,1H3,(H,20,23)
InChIKeyWNRVBVXINBTQNU-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

(3S)-N-(3-ethylphenyl)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 7935157
(3S)-1-(3-acetamidophenyl)-N-(3-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 92727083
N-(3-acetamidophenyl)-1-(3-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 42946699
1-(4-ethylphenyl)-5-oxo-N-phenylpyrrolidine-3-carboxamide
CID 3116947
N-(3-cyanophenyl)-1-(3-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 42946600
1-(4-ethylphenyl)-N-(3-methylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 3155517
N-(3-bromophenyl)-1-(4-ethylphenyl)-5-oxopyrrolidine-3-carboxamide
CID 4667771
N-[3-(2-methylpropanoylamino)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 2984442
(3R)-N-[3-(2-methylpropanoylamino)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 7220564
methyl 4-[[1-(3-ethylphenyl)-5-oxopyrrolidine-3-carbonyl]amino]benzoate
CID 42946684
N-(3-ethynylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 46446482
1-(4-ethylphenyl)-N-[3-(methanesulfonamido)phenyl]-5-oxopyrrolidine-3-carboxamide
CID 46570341

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The IUPAC name of N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide (CID 46687180) is N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide is CCc1cccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)c1.
What is the InChIKey of N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The InChIKey is WNRVBVXINBTQNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-2-14-7-6-8-16(11-14)20-19(23)15-12-18(22)21(13-15)17-9-4-3-5-10-17/h3-11,15H,2,12-13H2,1H3,(H,20,23).
What are the key properties of N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide?
N-(3-ethylphenyl)-5-oxo-1-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 N-(3-ethylphenyl)-5-oxo-1-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 46687180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).