N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide

C20H17FN4O3 — CID 110632162

IUPACN-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide
SMILESO=C(NCc1nc(-c2ccc(F)cc2)no1)C1CCC(=O)N1c1ccccc1
InChIInChI=1S/C20H17FN4O3/c21-14-8-6-13(7-9-14)19-23-17(28-24-19)12-22-20(27)16-10-11-18(26)25(16)15-4-2-1-3-5-15/h1-9,16H,10-12H2,(H,22,27)
InChIKeyZODDMRDRJDIGHC-UHFFFAOYSA-N
MW380.38 g/mol
LogP2.69
Rot. Bonds5

About N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide

N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide (PubChem CID 110632162) has the molecular formula C20H17FN4O3 and a molecular weight of 380.38 g/mol. Its IUPAC name is N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide
PubChem CID110632162
Molecular FormulaC20H17FN4O3
Molecular Weight380.38 g/mol
Exact Mass380.13
IUPAC NameN-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide
SMILESO=C(NCc1nc(-c2ccc(F)cc2)no1)C1CCC(=O)N1c1ccccc1
InChIInChI=1S/C20H17FN4O3/c21-14-8-6-13(7-9-14)19-23-17(28-24-19)12-22-20(27)16-10-11-18(26)25(16)15-4-2-1-3-5-15/h1-9,16H,10-12H2,(H,22,27)
InChIKeyZODDMRDRJDIGHC-UHFFFAOYSA-N
XLogP2.69
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.38
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide 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

1-(4-fluorophenyl)-N-[(2-methoxyphenyl)methyl]-5-oxopyrrolidine-2-carboxamide
CID 110373885
tert-butyl 2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylcarbamoyl]pyrrolidine-1-carboxylate
CID 110632203
5-oxo-N-[(2-oxo-1H-quinolin-3-yl)methyl]-1-phenylpyrrolidine-2-carboxamide
CID 110608828
N-benzyl-1-(4-methylphenyl)-5-oxopyrrolidine-2-carboxamide
CID 110373746
N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-[(3S)-oxolan-3-yl]acetamide
CID 126429340
N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-phenoxybutanamide
CID 110293525
1-(4-fluorophenyl)-N-(2-methylpropyl)-5-oxopyrrolidine-2-carboxamide
CID 110373855
N-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-(4-methylphenyl)sulfonyl-5-oxopyrrolidine-2-carboxamide
CID 17358775
5-oxo-1-phenyl-N-prop-2-enylpyrrolidine-2-carboxamide
CID 110406517
4-(2-fluorophenyl)-N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]butanamide
CID 110632193
4-(2-fluorophenyl)-N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-oxobutanamide
CID 110632195
N-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-(4-fluorophenyl)acetamide
CID 83289940

Frequently Asked Questions

What is the IUPAC name of N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide?
The IUPAC name of N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide (CID 110632162) is N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide.
What is the SMILES notation for N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide?
The canonical SMILES for N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide is O=C(NCc1nc(-c2ccc(F)cc2)no1)C1CCC(=O)N1c1ccccc1.
What is the InChIKey of N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide?
The InChIKey is ZODDMRDRJDIGHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FN4O3/c21-14-8-6-13(7-9-14)19-23-17(28-24-19)12-22-20(27)16-10-11-18(26)25(16)15-4-2-1-3-5-15/h1-9,16H,10-12H2,(H,22,27).
What are the key properties of N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide?
N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide has a molecular weight of 380.38 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-5-oxo-1-phenylpyrrolidine-2-carboxamide is sourced from PubChem (CID 110632162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).