N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide

C10H18N2O2 — CID 67938930

IUPACN,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide
SMILESCCN(CC)C(=O)C1CCN(C)C1=O
InChIInChI=1S/C10H18N2O2/c1-4-12(5-2)10(14)8-6-7-11(3)9(8)13/h8H,4-7H2,1-3H3
InChIKeyJISZKVGEMDDGMR-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.33
Rot. Bonds3

About N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide

N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide (PubChem CID 67938930) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide
PubChem CID67938930
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC NameN,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide
SMILESCCN(CC)C(=O)C1CCN(C)C1=O
InChIInChI=1S/C10H18N2O2/c1-4-12(5-2)10(14)8-6-7-11(3)9(8)13/h8H,4-7H2,1-3H3
InChIKeyJISZKVGEMDDGMR-UHFFFAOYSA-N
XLogP0.33
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(4-chlorophenyl)-N,N-diethyl-2-oxopyrrolidine-3-carboxamide
CID 20964248
1-methyl-2-oxo-N-propan-2-ylpyrrolidine-3-carboxamide
CID 161010004
1-ethyl-1-methyl-3-(1-methyl-2-oxopyrrolidin-3-yl)urea
CID 103683287
N,N-diethyl-1-methylpyrrolidine-2-carboxamide
CID 21365849
8-(dimethylamino)-N,N-diethyl-1-methyl-2-oxoazonane-4-carboxamide
CID 162798665
N,N-diethyl-2-(1-ethyl-2-oxopyrrolidin-3-yl)prop-2-enamide
CID 139820161
N,N-diethyl-2-(4-methyl-3-oxopiperazin-2-yl)acetamide;hydrochloride
CID 110282446
(4R,8R)-8-(cyclobutylamino)-N,N-diethyl-1-methyl-2-oxoazonane-4-carboxamide
CID 75411812
(3S)-1-methyl-2-oxo-N-phenylpyrrolidine-3-carboxamide
CID 129405236
3-[ethyl-(2-hydroxy-2-methylpropyl)amino]-1-methylpyrrolidin-2-one
CID 111547689
8-acetamido-N,N-diethyl-1-methyl-2-oxoazonane-4-carboxamide
CID 162846292
2-(1-methyl-2-oxopyrrolidin-3-yl)acetamide
CID 68993926

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide?
The IUPAC name of N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide (CID 67938930) is N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide is CCN(CC)C(=O)C1CCN(C)C1=O.
What is the InChIKey of N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide?
The InChIKey is JISZKVGEMDDGMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-4-12(5-2)10(14)8-6-7-11(3)9(8)13/h8H,4-7H2,1-3H3.
What are the key properties of N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide?
N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide has a molecular weight of 198.27 g/mol, XLogP of 0.33, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-methyl-2-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 67938930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).