N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide

C24H29N3O4 — CID 42853624

IUPACN-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)C1CCN(c2ccc(OCc3ccccc3)cc2)C1=O
InChIInChI=1S/C24H29N3O4/c28-23(25-11-13-26-14-16-30-17-15-26)22-10-12-27(24(22)29)20-6-8-21(9-7-20)31-18-19-4-2-1-3-5-19/h1-9,22H,10-18H2,(H,25,28)
InChIKeyPUGNXJJXDXIJAL-UHFFFAOYSA-N
MW423.51 g/mol
LogP2.07
Rot. Bonds8

About N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide

N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide (PubChem CID 42853624) has the molecular formula C24H29N3O4 and a molecular weight of 423.51 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide
PubChem CID42853624
Molecular FormulaC24H29N3O4
Molecular Weight423.51 g/mol
Exact Mass423.22
IUPAC NameN-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)C1CCN(c2ccc(OCc3ccccc3)cc2)C1=O
InChIInChI=1S/C24H29N3O4/c28-23(25-11-13-26-14-16-30-17-15-26)22-10-12-27(24(22)29)20-6-8-21(9-7-20)31-18-19-4-2-1-3-5-19/h1-9,22H,10-18H2,(H,25,28)
InChIKeyPUGNXJJXDXIJAL-UHFFFAOYSA-N
XLogP2.07
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.51
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-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

(3S)-1-(4-ethylphenyl)-N-(2-morpholin-4-ylethyl)-2-oxopyrrolidine-3-carboxamide
CID 92725776
1-(4-ethylphenyl)-2-oxo-N-(2-pyrrolidin-1-ylethyl)pyrrolidine-3-carboxamide
CID 20964236
(3S)-1-(4-ethylphenyl)-N-[2-(4-methylpiperazin-1-yl)ethyl]-2-oxopyrrolidine-3-carboxamide
CID 92765110
N-(3-morpholin-4-ylpropyl)-4-phenylmethoxybenzamide
CID 17459626
1-(3-fluorophenyl)-N-(3-morpholin-4-ylpropyl)-2-oxopyrrolidine-3-carboxamide
CID 46062378
4-phenylmethoxy-N-[12-[16-[12-[(4-phenylmethoxybenzoyl)amino]dodecyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadec-7-yl]dodecyl]benzamide
CID 102394555
1-(4-chlorophenyl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-oxopyrrolidine-3-carboxamide
CID 46347377
(3R)-1-(4-chlorophenyl)-2-oxo-N-(3-phenylpropyl)pyrrolidine-3-carboxamide
CID 95056108
(3S)-1-(4-chlorophenyl)-N-[2-(4-ethylpiperazin-1-yl)ethyl]-2-oxopyrrolidine-3-carboxamide
CID 92750593
2-oxo-1-(4-phenoxyphenyl)-N-(2-pyridin-2-ylethyl)pyrrolidine-3-carboxamide
CID 42853656
(3R)-1-(4-methoxyphenyl)-N-[2-(4-methoxyphenyl)ethyl]-2-oxopyrrolidine-3-carboxamide
CID 93331110
(3S)-1-(4-ethylphenyl)-2-oxo-N-(3-phenylpropyl)pyrrolidine-3-carboxamide
CID 94079884

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide (CID 42853624) is N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide is O=C(NCCN1CCOCC1)C1CCN(c2ccc(OCc3ccccc3)cc2)C1=O.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide?
The InChIKey is PUGNXJJXDXIJAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N3O4/c28-23(25-11-13-26-14-16-30-17-15-26)22-10-12-27(24(22)29)20-6-8-21(9-7-20)31-18-19-4-2-1-3-5-19/h1-9,22H,10-18H2,(H,25,28).
What are the key properties of N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide?
N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide has a molecular weight of 423.51 g/mol, XLogP of 2.07, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-2-oxo-1-(4-phenylmethoxyphenyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 42853624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).