N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide

C21H21F3N2O2 — CID 134047220

IUPACN-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
SMILESCN(Cc1ccccc1C(F)(F)F)C(=O)c1ccc(CN2CCCC2=O)cc1
InChIInChI=1S/C21H21F3N2O2/c1-25(14-17-5-2-3-6-18(17)21(22,23)24)20(28)16-10-8-15(9-11-16)13-26-12-4-7-19(26)27/h2-3,5-6,8-11H,4,7,12-14H2,1H3
InChIKeySQBQYOCZWVYMBP-UHFFFAOYSA-N
MW390.41 g/mol
LogP4.10
Rot. Bonds5

About N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide

N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide (PubChem CID 134047220) has the molecular formula C21H21F3N2O2 and a molecular weight of 390.41 g/mol. Its IUPAC name is N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound NameN-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
PubChem CID134047220
Molecular FormulaC21H21F3N2O2
Molecular Weight390.41 g/mol
Exact Mass390.16
IUPAC NameN-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
SMILESCN(Cc1ccccc1C(F)(F)F)C(=O)c1ccc(CN2CCCC2=O)cc1
InChIInChI=1S/C21H21F3N2O2/c1-25(14-17-5-2-3-6-18(17)21(22,23)24)20(28)16-10-8-15(9-11-16)13-26-12-4-7-19(26)27/h2-3,5-6,8-11H,4,7,12-14H2,1H3
InChIKeySQBQYOCZWVYMBP-UHFFFAOYSA-N
XLogP4.10
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.41
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide 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

N,N-dimethyl-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 94870727
N-methyl-4-(pyrazol-1-ylmethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
CID 134047303
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 32757723
N-methyl-N-[(3-methylthiophen-2-yl)methyl]-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 8749161
N-cyclopropyl-N-ethyl-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 86922752
4-(cyclopropanecarbonylamino)-N-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
CID 134047351
N-methyl-4-pyrazol-1-yl-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide
CID 134047405
N-[(4-bromophenyl)methyl]-N-methyl-3-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 9159383
N-[[2-[(4-ethylpiperazin-1-yl)methyl]phenyl]methyl]-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 55715224
4-[(2-oxopyrrolidin-1-yl)methyl]-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 51195842
N-ethyl-N-(4-fluorophenyl)-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 51198675
N-ethyl-N-naphthalen-1-yl-4-[(2-oxopyrrolidin-1-yl)methyl]benzamide
CID 55614899

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide?
The IUPAC name of N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide (CID 134047220) is N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide.
What is the SMILES notation for N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide?
The canonical SMILES for N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide is CN(Cc1ccccc1C(F)(F)F)C(=O)c1ccc(CN2CCCC2=O)cc1.
What is the InChIKey of N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide?
The InChIKey is SQBQYOCZWVYMBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21F3N2O2/c1-25(14-17-5-2-3-6-18(17)21(22,23)24)20(28)16-10-8-15(9-11-16)13-26-12-4-7-19(26)27/h2-3,5-6,8-11H,4,7,12-14H2,1H3.
What are the key properties of N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide?
N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide has a molecular weight of 390.41 g/mol, XLogP of 4.10, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(2-oxopyrrolidin-1-yl)methyl]-N-[[2-(trifluoromethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 134047220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).