1-Methyl-2-piperidinemethanol

C₇H₁₅NOCAS 20845-34-5129.20 g/mol

Open in Covalent MOL file

Alcohol Tertiary amine

Properties

Molecular formula: C₇H₁₅NO
Molar mass: 129.20 g/mol
Exact mass: 129.1154 Da
Boiling point: 96–98 °C (at 19 Torr)
logP: 0.46Crippen estimate
Polar surface area: 23.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Warning

H227 Combustible liquid16.7% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, P501

Identifiers

CAS number

20845-34-5

SMILES

CN1CCCCC1CO

InChIKey

HXXJMMLIEYAFOZ-UHFFFAOYSA-N

InChI

InChI=1S/C7H15NO/c1-8-5-3-2-4-7(8)6-9/h7,9H,2-6H2,1H3

Weigh it out

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

Names and synonyms

9 names

2-Piperidinemethanol, 1-methyl-
2-Hydroxymethyl-N-methylpiperidine
(1-Methyl-2-piperidyl)methanol
N-Methyl-2-piperidinemethanol
(±)-2-Hydroxymethyl-1-methylpiperidine
(1-Methylpiperidin-2-yl)methanol
2-Hydroxymethyl-1-methylpiperidine
NSC 45464
1-Methyl-2-(hydroxymethyl)piperidine

Work with 1-Methyl-2-piperidinemethanol

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-pyrrolidinemethanol34381-71-087 % similar 1-Methyl-2-pyrrolidinemethanol3554-65-287 % similar N-Methyl-D-prolinol99494-01-687 % similar 1-Methyl-2-pyrrolidineethanol67004-64-257 % similar (1,4-Dimethylpiperazin-2-yl)methanol14675-44-650 % similar 2-(2-Chloroethyl)-1-methylpiperidine hydrochloride58878-37-850 % similar 2-(2-Aminoethyl)-1-methylpyrrolidine51387-90-747 % similar Lupinine486-70-445 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(S)-2-(Piperidin-2-yl)ethanol103639-57-2 Diethylpropionamide1114-51-8 1-tert-Butyl-3-hydroxyazetidine13156-04-2 1-Ethyl-3-piperidinol13444-24-1 ((1s,4s)-4-Aminocyclohexyl)methanol1467-84-1 2-Piperidineethanol1484-84-0 1-Methylazepan-4-ol19065-49-7 1-Pyrrolidinepropanol19748-66-4

Elsewhere

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