2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide

C13H25N3O2 — CID 83071737

IUPAC2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide
SMILESCCCNC(=O)CN(C)C(=O)C1(CC)CCCN1
InChIInChI=1S/C13H25N3O2/c1-4-8-14-11(17)10-16(3)12(18)13(5-2)7-6-9-15-13/h15H,4-10H2,1-3H3,(H,14,17)
InChIKeyIYBUURHOKYOBKA-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.50
Rot. Bonds6

About 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide

2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide (PubChem CID 83071737) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide
PubChem CID83071737
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide
SMILESCCCNC(=O)CN(C)C(=O)C1(CC)CCCN1
InChIInChI=1S/C13H25N3O2/c1-4-8-14-11(17)10-16(3)12(18)13(5-2)7-6-9-15-13/h15H,4-10H2,1-3H3,(H,14,17)
InChIKeyIYBUURHOKYOBKA-UHFFFAOYSA-N
XLogP0.50
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N-methyl-N-(2-methylbutyl)pyrrolidine-2-carboxamide
CID 83079995
1-carbamothioyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]cyclopentane-1-carboxamide
CID 55037771
N-methyl-N-[2-(methylamino)ethyl]-2-propylpyrrolidine-2-carboxamide
CID 106975276
2-ethyl-N-methyl-N-propan-2-ylpyrrolidine-2-carboxamide
CID 83080860
N-cyclopropyl-2-ethyl-N-methylpyrrolidine-2-carboxamide
CID 83080870
2-ethyl-N-methyl-N-(1,3-thiazol-4-ylmethyl)pyrrolidine-2-carboxamide
CID 83071366
N-[2-(dimethylsulfamoyl)ethyl]-2-ethylpyrrolidine-2-carboxamide
CID 106337546
N-methyl-N-[2-oxo-2-(propylamino)ethyl]piperidine-3-carboxamide
CID 54868907
2-ethyl-N-[3-(methylamino)-3-oxopropyl]pyrrolidine-2-carboxamide
CID 83071991
N-(2-amino-2-oxoethyl)-2-ethyl-N-propan-2-ylpyrrolidine-2-carboxamide
CID 83079558
N-(1-cyanopropan-2-yl)-2-ethyl-N-methylpyrrolidine-2-carboxamide
CID 83072233
2-ethyl-N-pentyl-N-propan-2-ylpyrrolidine-2-carboxamide
CID 83071421

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide (CID 83071737) is 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide is CCCNC(=O)CN(C)C(=O)C1(CC)CCCN1.
What is the InChIKey of 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is IYBUURHOKYOBKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-4-8-14-11(17)10-16(3)12(18)13(5-2)7-6-9-15-13/h15H,4-10H2,1-3H3,(H,14,17).
What are the key properties of 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide?
2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 0.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methyl-N-[2-oxo-2-(propylamino)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 83071737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).