N-Ethyl-2-pyrrolidone

C6H11NOCAS 2687-91-4113.16 g/mol

Open in Covalent MOL file
NO
AmideLactam

Properties

Molecular formula
C6H11NO
Molar mass
113.16 g/mol
Exact mass
113.0841 Da
Melting point
87.5–88.5 °C
Boiling point
97 °C
logP
0.63Crippen estimate
Polar surface area
20.3 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Danger
Health Hazard (GHS08)

Harmonised EU classification (CLP Annex VI, index 616-208-00-5), via PubChem.

Precautionary statements

P203, P280, P318, P405, P501

Identifiers

CAS number
2687-91-4
SMILES
CCN1CCCC1=O
InChIKey
ZFPGARUNNKGOBB-UHFFFAOYSA-N
InChI
InChI=1S/C6H11NO/c1-2-7-5-3-4-6(7)8/h2-5H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all
  • 2-Pyrrolidinone, 1-ethyl-
  • 1-Ethyl-2-pyrrolidinone
  • 1-Ethyl-2-pyrrolidone
  • N-Ethylpyrrolidone
  • N-Ethyl-2-pyrrolidinone
  • N-Ethylpyrrolidinone
  • N-Ethyl-α-pyrrolidinone
  • 1-Ethylazacyclopentan-2-one
  • N-Ethylbutyrolactam
  • N-Ethyl-γ-butyrolactam
  • NEP
  • NEP 100
  • E 0358

Work with N-Ethyl-2-pyrrolidone

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Butyl-2-pyrrolidone3470-98-265 % similar N-Octylpyrrolidone2687-94-761 % similar N-Dodecyl-2-pyrrolidone2687-96-961 % similar N,N-Diethyldodecanamide3352-87-261 % similar N-(Hydroxymethyl)-2-pyrrolidone15438-71-856 % similar Laurocapram59227-89-355 % similar 1-(2-Hydroxyethyl)-2-pyrrolidinone3445-11-254 % similar 1-(3-Hydroxypropyl)pyrrolidin-2-one62012-15-154 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Cyclohexanone oxime100-64-1 Caprolactam105-60-2 (1S,4R)-4-Amino-2-cyclopentene-1-methanol136522-35-5 1-Methyl-4-piperidone1445-73-4 2,2-Dimethylcyclopropanecarboxamide1759-55-3 2,4,4-Trimethyl-2-oxazoline1772-43-6 N-Isopropylacrylamide2210-25-5 2,4,5-Trimethyl-3-oxazoline22694-96-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook