N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide

C13H24N2O3 — CID 51361552

IUPACN-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCOCCN1C(=O)CCC1(C)C(=O)NC(C)(C)C
InChIInChI=1S/C13H24N2O3/c1-12(2,3)14-11(17)13(4)7-6-10(16)15(13)8-9-18-5/h6-9H2,1-5H3,(H,14,17)
InChIKeySXFOBTDNURZEGB-UHFFFAOYSA-N
MW256.35 g/mol
LogP0.93
Rot. Bonds4

About N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide

N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide (PubChem CID 51361552) has the molecular formula C13H24N2O3 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
PubChem CID51361552
Molecular FormulaC13H24N2O3
Molecular Weight256.35 g/mol
Exact Mass256.18
IUPAC NameN-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
SMILESCOCCN1C(=O)CCC1(C)C(=O)NC(C)(C)C
InChIInChI=1S/C13H24N2O3/c1-12(2,3)14-11(17)13(4)7-6-10(16)15(13)8-9-18-5/h6-9H2,1-5H3,(H,14,17)
InChIKeySXFOBTDNURZEGB-UHFFFAOYSA-N
XLogP0.93
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-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

N-cyclohexyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 51361540
N-tert-butyl-2-methyl-5-oxo-1-(2,2,2-trifluoroethyl)pyrrolidine-2-carboxamide
CID 51361561
N-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 51361548
N-tert-butyl-1-cyclopropyl-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 51361562
N-cyclopentyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 51361544
N-cyclopentyl-2-methyl-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-2-carboxamide
CID 4103169
N-cyclopentyl-1-ethyl-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 45106070
N-Cyclopentyl-2-methyl-1-[3-(morpholin-4-YL)propyl]-5-oxopyrrolidine-2-carboxamide
CID 46247075
2-Methyl-N-(3-methylbutyl)-1-[3-(morpholin-4-YL)propyl]-5-oxopyrrolidine-2-carboxamide
CID 46247124
N-butyl-1-cyclopropyl-2-methyl-5-oxopyrrolidine-2-carboxamide
CID 51361558
(2S)-1-[(1R)-1-cyclopropyl-2-(methylamino)-2-oxoethyl]-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
CID 75529693
N-(2-Methoxyethyl)-5-oxo-1-(piperidin-4-YL)pyrrolidine-2-carboxamide
CID 86820482

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide?
The IUPAC name of N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide (CID 51361552) is N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide.
What is the SMILES notation for N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide?
The canonical SMILES for N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide is COCCN1C(=O)CCC1(C)C(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide?
The InChIKey is SXFOBTDNURZEGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3/c1-12(2,3)14-11(17)13(4)7-6-10(16)15(13)8-9-18-5/h6-9H2,1-5H3,(H,14,17).
What are the key properties of N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide?
N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide has a molecular weight of 256.35 g/mol, XLogP of 0.93, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-(2-methoxyethyl)-2-methyl-5-oxopyrrolidine-2-carboxamide is sourced from PubChem (CID 51361552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).