N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide

C26H35N3O5 — CID 55566611

IUPACN-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCN(CC)C(CNC(=O)C1CC(=O)N(c2ccc(OC)c(OC)c2)C1)c1cccc(OC)c1
InChIInChI=1S/C26H35N3O5/c1-6-28(7-2)22(18-9-8-10-21(13-18)32-3)16-27-26(31)19-14-25(30)29(17-19)20-11-12-23(33-4)24(15-20)34-5/h8-13,15,19,22H,6-7,14,16-17H2,1-5H3,(H,27,31)
InChIKeyCWMVTNUIZBIMIV-UHFFFAOYSA-N
MW469.58 g/mol
LogP3.26
Rot. Bonds11

About N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide

N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 55566611) has the molecular formula C26H35N3O5 and a molecular weight of 469.58 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
PubChem CID55566611
Molecular FormulaC26H35N3O5
Molecular Weight469.58 g/mol
Exact Mass469.26
IUPAC NameN-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide
SMILESCCN(CC)C(CNC(=O)C1CC(=O)N(c2ccc(OC)c(OC)c2)C1)c1cccc(OC)c1
InChIInChI=1S/C26H35N3O5/c1-6-28(7-2)22(18-9-8-10-21(13-18)32-3)16-27-26(31)19-14-25(30)29(17-19)20-11-12-23(33-4)24(15-20)34-5/h8-13,15,19,22H,6-7,14,16-17H2,1-5H3,(H,27,31)
InChIKeyCWMVTNUIZBIMIV-UHFFFAOYSA-N
XLogP3.26
TPSA80.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500469.58
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide 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

1-(3,4-dimethoxyphenyl)-5-oxo-N-(2-pyrrolidin-1-ylpropyl)pyrrolidine-3-carboxamide
CID 110620533
(3R)-N-[3-(diethylamino)propyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 9376315
N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-2-(3,4-dimethoxyphenyl)acetamide
CID 55470741
N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-3,4-dimethoxybenzamide
CID 51283235
N-butyl-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 46556786
(3R)-N-[2-(cyclopropanecarbonylamino)ethyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 29128274
N-[2-(cyclopropanecarbonylamino)ethyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 42650892
1-(3,4-dimethoxyphenyl)-5-oxo-N-pentan-3-ylpyrrolidine-3-carboxamide
CID 134060426
(3R)-N-[3-(dimethylamino)propyl]-1-(3-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide
CID 9375419
1-(3,4-dimethoxyphenyl)-N-[(2,4-dimethoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 46586700
3-amino-N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]cyclopentane-1-carboxamide
CID 119837688
(3S)-1-(3-methoxyphenyl)-5-oxo-N-pentan-3-ylpyrrolidine-3-carboxamide
CID 9376616

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide (CID 55566611) is N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide is CCN(CC)C(CNC(=O)C1CC(=O)N(c2ccc(OC)c(OC)c2)C1)c1cccc(OC)c1.
What is the InChIKey of N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is CWMVTNUIZBIMIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H35N3O5/c1-6-28(7-2)22(18-9-8-10-21(13-18)32-3)16-27-26(31)19-14-25(30)29(17-19)20-11-12-23(33-4)24(15-20)34-5/h8-13,15,19,22H,6-7,14,16-17H2,1-5H3,(H,27,31).
What are the key properties of N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide?
N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 469.58 g/mol, XLogP of 3.26, 11 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-2-(3-methoxyphenyl)ethyl]-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 55566611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).