chempirical

N,N-Dimethylpiperidin-4-amine

C7H16N2CAS 50533-97-6128.22 g/mol

Open in Covalent MOL file
NNH
Secondary amineTertiary amine

Properties

Molecular formula
C7H16N2
Molar mass
128.22 g/mol
Exact mass
128.1313 Da
Boiling point
182–187 °C
logP
0.30Crippen estimate
Polar surface area
15.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 64 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, P501

Identifiers

CAS number
50533-97-6
SMILES
CN(C)C1CCNCC1
InChIKey
YFJAIURZMRJPDB-UHFFFAOYSA-N
InChI
InChI=1S/C7H16N2/c1-9(2)7-3-5-8-6-4-7/h7-8H,3-6H2,1-2H3

Weigh it out

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

Names and synonyms

7 names
  • 4-(Dimethylamino)piperidine
  • 4-Piperidinamine, N,N-dimethyl-
  • Piperidine, 4-(dimethylamino)-
  • N,N-Dimethyl-4-piperidinamine
  • 4-(N,N-Dimethylamino)piperidine
  • N,N-Dimethyl-N-(4-piperidinyl)amine
  • Dimethyl(piperidin-4-yl)amine

Work with N,N-Dimethylpiperidin-4-amine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

4-(Dimethylamino)piperidine dihydrochloride4876-59-9Salt

Similar compounds

(3S)-(-)-3-(Dimethylamino)pyrrolidine132883-44-471 % similar (3R)-(+)-3-(Dimethylamino)pyrrolidine132958-72-671 % similar 3-(Dimethylamino)pyrrolidine69478-75-771 % similar (S)-3-Dimethylaminopyrrolidine 2hcl144043-20-963 % similar N,N-Dimethylcyclohexylamine98-94-252 % similar 3-(Dimethylamino)piperidine50534-49-152 % similar 1-Methyl-4-(piperidin-4-yl)piperazine53617-36-050 % similar 3-(Dimethylamino)azetidine dihydrochloride124668-49-146 % similar

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

Same formula

(1-Methylpiperidin-3-yl)methanamine14613-37-7 1-Propylpiperazine21867-64-1 (2R)-1-Ethyl-2-pyrrolidinemethanamine22795-97-7 (2S)-1-Ethyl-2-pyrrolidinemethanamine22795-99-9 1-Pyrrolidinepropanamine23159-07-1 2-Aminomethyl-1-ethylpyrrolidine26116-12-1 1-Piperidineethanamine27578-60-5 1-Ethylhomopiperazine3619-73-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook