N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide

C20H21FN2O2 — CID 51198675

IUPACN-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
SMILESCCN(C(=O)c1ccc(CN2CCCC2=O)cc1)c1ccc(F)cc1
InChIInChI=1S/C20H21FN2O2/c1-2-23(18-11-9-17(21)10-12-18)20(25)16-7-5-15(6-8-16)14-22-13-3-4-19(22)24/h5-12H,2-4,13-14H2,1H3
InChIKeyZPUFXBCSEMGULU-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.61
Rot. Bonds5

About N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide

N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide (PubChem CID 51198675) has the molecular formula C20H21FN2O2 and a molecular weight of 340.40 g/mol. Its IUPAC name is N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide.

Molecular Properties

Compound NameN-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
PubChem CID51198675
Molecular FormulaC20H21FN2O2
Molecular Weight340.40 g/mol
Exact Mass340.16
IUPAC NameN-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
SMILESCCN(C(=O)c1ccc(CN2CCCC2=O)cc1)c1ccc(F)cc1
InChIInChI=1S/C20H21FN2O2/c1-2-23(18-11-9-17(21)10-12-18)20(25)16-7-5-15(6-8-16)14-22-13-3-4-19(22)24/h5-12H,2-4,13-14H2,1H3
InChIKeyZPUFXBCSEMGULU-UHFFFAOYSA-N
XLogP3.61
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-naphthalen-1-yl-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 55614899
N,N-dimethyl-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 94870727
N-cyclopropyl-N-ethyl-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 86922752
N-(4-fluorophenyl)-3,4-dimethyl-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 3244651
N-(3-chloro-4-methylphenyl)-4-fluoro-N-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 4099523
1-[(4-fluorophenyl)methyl]azepan-2-one
CID 154273809
(4-fluorophenyl)methyl 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate
CID 86906530
N-[(1R)-1-(4-fluorophenyl)ethyl]-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 94012016
[(1R)-1-(4-fluorophenyl)ethyl] 4-[(2-oxopyrrolidin-1-yl)methyl]benzoate
CID 7491563
2-(4-fluoro-N-methylsulfonylanilino)-N-[[4-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]acetamide
CID 30221989
4-[(2-oxopyrrolidin-1-yl)methyl]-N-propylbenzamide
CID 32745199
1-[(4-fluorophenyl)methyl]azetidin-2-one
CID 175277158

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The IUPAC name of N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide (CID 51198675) is N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide.
What is the SMILES notation for N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The canonical SMILES for N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide is CCN(C(=O)c1ccc(CN2CCCC2=O)cc1)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
The InChIKey is ZPUFXBCSEMGULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21FN2O2/c1-2-23(18-11-9-17(21)10-12-18)20(25)16-7-5-15(6-8-16)14-22-13-3-4-19(22)24/h5-12H,2-4,13-14H2,1H3.
What are the key properties of N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide?
N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide has a molecular weight of 340.40 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide is sourced from PubChem (CID 51198675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).