chempirical

2,2-Dimethylpyrrolidine

C6H13NCAS 35018-15-699.18 g/mol

Open in Covalent MOL file
NH
Secondary amine

Properties

Molecular formula
C6H13N
Molar mass
99.18 g/mol
Exact mass
99.1048 Da
logP
1.15Crippen estimate
Polar surface area
12.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
35018-15-6
SMILES
CC1(CCCN1)C
InChIKey
PHODFIDDEBEGCS-UHFFFAOYSA-N
InChI
InChI=1S/C6H13N/c1-6(2)4-3-5-7-6/h7H,3-5H2,1-2H3

Weigh it out

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

Names and synonyms

8 names
  • Pyrrolidine, 2,2-dimethyl-
  • 2,2-Dimethyl-pyrrolidine
  • Pyrrolidine,2,2-dimethyl-
  • 22-Dimethylpyrrolidine
  • 2.2-Dimethylpyrrolidin
  • 2,2-Dimethyl-pyrolidine
  • 2,2,-Dimethylpyrrolidine
  • 2,2-Dimethylpyrrolidine, AldrichCPR

Work with 2,2-Dimethylpyrrolidine

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2-Dimethylpyrrolidine hydrochloride623580-01-884 % similar 2,2,6,6-Tetramethylpiperidine768-66-150 % similar 2-Methyl-L-proline42856-71-337 % similar 3,3-Dimethylpiperidine1193-12-036 % similar N,N′-Di-tert-butylethylenediamine4062-60-633 % similar 4,4-Dimethyloxazolidine51200-87-432 % similar N,N′-Bis(2,2,6,6-tetramethyl-4-piperidinyl)-1,6-hexanediamine61260-55-731 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Cyclohexylamine108-91-8 2-Methylpiperidine109-05-7 Azepane111-49-9 N-Ethyl-2-methylallylamine18328-90-0 3-Methylpiperidine626-56-2 4-Methylpiperidine626-58-4 N-Methylpiperidine626-67-5 1-Ethylpyrrolidine7335-06-0

Elsewhere

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