chempirical

1-Methyl-2-pyrrolidinemethanol

C6H13NOCAS 3554-65-2115.18 g/mol

Open in Covalent MOL file
NHO
AlcoholTertiary amine

Properties

Molecular formula
C6H13NO
Molar mass
115.18 g/mol
Exact mass
115.0997 Da
Boiling point
67–68 °C (at 12 Torr)
logP
0.07Crippen estimate
Polar surface area
23.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
3554-65-2
SMILES
CN1CCCC1CO
InChIKey
VCOJPHPOVDIRJK-UHFFFAOYSA-N
InChI
InChI=1S/C6H13NO/c1-7-4-2-3-6(7)5-8/h6,8H,2-5H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • 2-Pyrrolidinemethanol, 1-methyl-
  • 2-(Hydroxymethyl)-1-methylpyrrolidine
  • (±)-1-Methyl-2-pyrrolidinemethanol
  • N-Methylpyrrolidine-2-methanol
  • (1-Methylpyrrolidin-2-yl)methanol
  • NSC 45497
  • N-Methylprolinol

Work with 1-Methyl-2-pyrrolidinemethanol

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

(2S)-1-Methyl-2-pyrrolidinemethanol34381-71-0100 % similar 1-Methyl-2-piperidinemethanol20845-34-587 % similar 1-Methyl-2-pyrrolidineethanol67004-64-265 % similar 2-(2-Aminoethyl)-1-methylpyrrolidine51387-90-754 % similar 2-(2-Chloroethyl)-N-methylpyrrolidine hydrochloride56824-22-748 % similar 2-(2-Chloroethyl)-1-methylpiperidine hydrochloride58878-37-842 % similar Lupinine486-70-442 % similar 1-Methyl-3-piperidinemethanol7583-53-142 % similar

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

Same formula

Ethylmorpholine100-74-3 [1-Aminocyclopentyl]methanol10316-79-7 4-Hydroxy-1-methylpiperidine106-52-5 4-Aminomethyltetrahydropyran130290-79-8 1-Propylazetidin-3-ol1340301-52-1 2,6-Dimethylmorpholine141-91-3 trans-4-Aminocyclohexanol27489-62-9 1-Pyrrolidineethanol2955-88-6

Elsewhere

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