4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide

C19H17ClF2N2O3 — CID 18143926

IUPAC4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide
SMILESO=C(NCc1ccccc1OC(F)F)c1ccc(Cl)c(N2CCCC2=O)c1
InChIInChI=1S/C19H17ClF2N2O3/c20-14-8-7-12(10-15(14)24-9-3-6-17(24)25)18(26)23-11-13-4-1-2-5-16(13)27-19(21)22/h1-2,4-5,7-8,10,19H,3,6,9,11H2,(H,23,26)
InChIKeyOLAIJFOPPDAOKL-UHFFFAOYSA-N
MW394.81 g/mol
LogP4.00
Rot. Bonds6

About 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide

4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide (PubChem CID 18143926) has the molecular formula C19H17ClF2N2O3 and a molecular weight of 394.81 g/mol. Its IUPAC name is 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide.

Molecular Properties

Compound Name4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide
PubChem CID18143926
Molecular FormulaC19H17ClF2N2O3
Molecular Weight394.81 g/mol
Exact Mass394.09
IUPAC Name4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide
SMILESO=C(NCc1ccccc1OC(F)F)c1ccc(Cl)c(N2CCCC2=O)c1
InChIInChI=1S/C19H17ClF2N2O3/c20-14-8-7-12(10-15(14)24-9-3-6-17(24)25)18(26)23-11-13-4-1-2-5-16(13)27-19(21)22/h1-2,4-5,7-8,10,19H,3,6,9,11H2,(H,23,26)
InChIKeyOLAIJFOPPDAOKL-UHFFFAOYSA-N
XLogP4.00
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.81
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)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-benzhydryl-4-chloro-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9046061
4-chloro-N'-[2-(4-fluorophenyl)acetyl]-3-(2-oxopyrrolidin-1-yl)benzohydrazide
CID 9161741
4-chloro-3-(2-oxopyrrolidin-1-yl)-N-[(1S)-1-phenylethyl]benzamide
CID 9032786
4-chloro-N-[2-(4-chlorophenoxy)ethyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9297692
4-chloro-N-[3-(N-methylanilino)-3-oxopropyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 154773860
4-chloro-N-[2-oxo-2-(propylamino)ethyl]-3-(2-oxopyrrolidin-1-yl)benzamide
CID 9163408
methyl 3-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]-3-phenylpropanoate
CID 24516853
[(2S)-1-oxo-1-(2-phenylethylamino)propan-2-yl] 4-chloro-3-(2-oxopyrrolidin-1-yl)benzoate
CID 9305090
[(2R)-1-oxo-1-(2-phenylethylamino)propan-2-yl] 4-chloro-3-(2-oxopyrrolidin-1-yl)benzoate
CID 9305093
methyl 2-[[4-chloro-3-(2-oxopyrrolidin-1-yl)benzoyl]amino]benzoate
CID 18200069
1-[[2-(difluoromethoxy)phenyl]methyl]-3-[[3-[(2-oxopyrrolidin-1-yl)methyl]phenyl]methyl]urea
CID 78870413
4-chloro-3-(2-oxoimidazolidin-1-yl)-N-[[3-(2-oxopyrrolidin-1-yl)phenyl]methyl]benzamide
CID 166216311

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide?
The IUPAC name of 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide (CID 18143926) is 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide.
What is the SMILES notation for 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide?
The canonical SMILES for 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide is O=C(NCc1ccccc1OC(F)F)c1ccc(Cl)c(N2CCCC2=O)c1.
What is the InChIKey of 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide?
The InChIKey is OLAIJFOPPDAOKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClF2N2O3/c20-14-8-7-12(10-15(14)24-9-3-6-17(24)25)18(26)23-11-13-4-1-2-5-16(13)27-19(21)22/h1-2,4-5,7-8,10,19H,3,6,9,11H2,(H,23,26).
What are the key properties of 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide?
4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide has a molecular weight of 394.81 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[[2-(difluoromethoxy)phenyl]methyl]-3-(2-oxopyrrolidin-1-yl)benzamide is sourced from PubChem (CID 18143926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).