2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide

C21H26N2O3 — CID 112503241

IUPAC2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide
SMILESCOc1cccc(OC)c1C(=O)NCC(c1ccccc1)N1CCCC1
InChIInChI=1S/C21H26N2O3/c1-25-18-11-8-12-19(26-2)20(18)21(24)22-15-17(23-13-6-7-14-23)16-9-4-3-5-10-16/h3-5,8-12,17H,6-7,13-15H2,1-2H3,(H,22,24)
InChIKeyZASRBCCXEJSJQJ-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.27
Rot. Bonds7

About 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide

2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide (PubChem CID 112503241) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide.

Molecular Properties

Compound Name2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide
PubChem CID112503241
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide
SMILESCOc1cccc(OC)c1C(=O)NCC(c1ccccc1)N1CCCC1
InChIInChI=1S/C21H26N2O3/c1-25-18-11-8-12-19(26-2)20(18)21(24)22-15-17(23-13-6-7-14-23)16-9-4-3-5-10-16/h3-5,8-12,17H,6-7,13-15H2,1-2H3,(H,22,24)
InChIKeyZASRBCCXEJSJQJ-UHFFFAOYSA-N
XLogP3.27
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)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

2,6-dimethoxy-N-[2-(3-methoxyphenyl)-2-piperidin-1-ylethyl]benzamide
CID 112506691
N-[2-(3-chlorophenyl)-2-pyrrolidin-1-ylethyl]-2,6-dimethoxybenzamide
CID 112506810
2,6-dimethoxy-N-(2-piperidin-1-yl-2-thiophen-3-ylethyl)benzamide
CID 16931257
3,4-dimethoxy-N-(2-phenyl-2-piperidin-1-ylethyl)benzamide
CID 110357424
2,6-difluoro-N-[(2S)-2-phenyl-2-pyrrolidin-1-ylethyl]benzamide
CID 51931088
2-(3,4-dimethoxyphenyl)-N-(2-phenyl-2-pyrrolidin-1-ylethyl)acetamide
CID 51179547
2-ethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide
CID 45155494
N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2,4,6-trimethylbenzamide
CID 112810457
4-amino-5-chloro-2-methoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide
CID 119831449
3-methoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)-4-prop-2-enoxybenzamide
CID 24624995
N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-2-phenylacetamide;hydrochloride
CID 52984976
methyl 4-[[2-(2-methoxyphenyl)-2-piperidin-1-ylethyl]carbamoyl]benzoate
CID 60533855

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide?
The IUPAC name of 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide (CID 112503241) is 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide.
What is the SMILES notation for 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide?
The canonical SMILES for 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide is COc1cccc(OC)c1C(=O)NCC(c1ccccc1)N1CCCC1.
What is the InChIKey of 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide?
The InChIKey is ZASRBCCXEJSJQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-25-18-11-8-12-19(26-2)20(18)21(24)22-15-17(23-13-6-7-14-23)16-9-4-3-5-10-16/h3-5,8-12,17H,6-7,13-15H2,1-2H3,(H,22,24).
What are the key properties of 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide?
2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide has a molecular weight of 354.45 g/mol, XLogP of 3.27, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethoxy-N-(2-phenyl-2-pyrrolidin-1-ylethyl)benzamide is sourced from PubChem (CID 112503241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).