4-(1-Pyrrolidinyl)piperidine

C₉H₁₈N₂CAS 5004-07-9154.26 g/mol

Open in Covalent MOL file

Secondary amine Tertiary amine

Properties

Molecular formula: C₉H₁₈N₂
Molar mass: 154.26 g/mol
Exact mass: 154.1470 Da
Melting point: 57–59 °C
logP: 0.83Crippen estimate
Polar surface area: 15.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Danger

H314 Causes severe skin burns and eye damage10.9% of notifiers
H315 Causes skin irritation89.1% of notifiers
H319 Causes serious eye irritation89.1% of notifiers
H335 May cause respiratory irritation87% of notifiers

Aggregated from 46 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, P501

Identifiers

CAS number

5004-07-9

SMILES

C1CCN(C2CCNCC2)C1

InChIKey

STWODXDTKGTVCJ-UHFFFAOYSA-N

InChI

InChI=1S/C9H18N2/c1-2-8-11(7-1)9-3-5-10-6-4-9/h9-10H,1-8H2

Weigh it out

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

Names and synonyms

5 names

Piperidine, 4-(1-pyrrolidinyl)-
4-Pyrrolidinopiperidine
4-(Pyrrolidinyl)piperidine
4-(1-Pyrrolidino)piperidine
1-(Piperidin-4-yl)pyrrolidine

Work with 4-(1-Pyrrolidinyl)piperidine

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

1,4′-Bipiperidine4897-50-195 % similar 1,4′-Bipiperidine, hydrochloride (1:2)4876-60-282 % similar 1-Cyclopropylpiperazine20327-23-565 % similar 1-Cyclohexylpiperazine17766-28-864 % similar 1-Cycloheptylpiperazine21043-42-564 % similar 1-Cyclooctylpiperazine21043-43-664 % similar 4-(Piperidin-4-yl)morpholine53617-35-963 % similar 1-Methyl-4-(piperidin-4-yl)piperazine53617-36-060 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Cyclopentylpiperazine21043-40-3 (S)-(+)-1-(2-Pyrrolidinylmethyl)pyrrolidine51207-66-0 N,N′-Methanetetraylbis[2-methyl-2-propanamine]691-24-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook