N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide

C20H22N2O2 — CID 110295271

IUPACN-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C20H22N2O2/c1-2-21(15-16-7-4-3-5-8-16)20(24)17-10-12-18(13-11-17)22-14-6-9-19(22)23/h3-5,7-8,10-13H,2,6,9,14-15H2,1H3
InChIKeyXMEGKLHJJKTYHY-UHFFFAOYSA-N
MW322.41 g/mol
LogP3.48
Rot. Bonds5

About N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide

N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 110295271) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound NameN-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID110295271
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC NameN-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide
SMILESCCN(Cc1ccccc1)C(=O)c1ccc(N2CCCC2=O)cc1
InChIInChI=1S/C20H22N2O2/c1-2-21(15-16-7-4-3-5-8-16)20(24)17-10-12-18(13-11-17)22-14-6-9-19(22)23/h3-5,7-8,10-13H,2,6,9,14-15H2,1H3
InChIKeyXMEGKLHJJKTYHY-UHFFFAOYSA-N
XLogP3.48
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-4-(2-oxopyrrolidin-1-yl)-N-[(4-oxo-3H-quinazolin-2-yl)methyl]benzamide
CID 135821098
N-benzyl-N-methyl-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 27666071
N,N-diethyl-4-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]benzamide
CID 32620770
N-[(3-chlorophenyl)methyl]-N-methyl-4-(2-oxopyrrolidin-1-yl)benzamide
CID 27795184
N-[(4-ethoxyphenyl)methyl]-N-methyl-4-(2-oxopyrrolidin-1-yl)benzamide
CID 27822823
N-ethyl-4-(2-oxopyrrolidin-1-yl)-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]benzamide
CID 4782385
N-methyl-4-(2-oxopyrrolidin-1-yl)-N-(1-phenylethyl)benzamide
CID 51188170
N-(2-benzamidoethyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 24659936
N-[[2-(diethylaminomethyl)phenyl]methyl]-4-(2-oxopyrrolidin-1-yl)benzamide
CID 9073524
[(2S)-1-[benzyl(tert-butyl)amino]-1-oxopropan-2-yl] 4-(2-oxopyrrolidin-1-yl)benzoate
CID 8545000
1-[[4-(diethylaminomethyl)phenyl]methyl]-3-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]urea
CID 17489033
3-[benzyl(methyl)amino]-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide
CID 17397146

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide (CID 110295271) is N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide is CCN(Cc1ccccc1)C(=O)c1ccc(N2CCCC2=O)cc1.
What is the InChIKey of N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is XMEGKLHJJKTYHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-2-21(15-16-7-4-3-5-8-16)20(24)17-10-12-18(13-11-17)22-14-6-9-19(22)23/h3-5,7-8,10-13H,2,6,9,14-15H2,1H3.
What are the key properties of N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide?
N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 322.41 g/mol, XLogP of 3.48, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-ethyl-4-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 110295271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).