chempirical

N-Cyclohexyl-1,3-propanediamine

C9H20N2CAS 3312-60-5156.27 g/mol

Open in Covalent MOL file
H2NHN
Primary amineSecondary amine

Properties

Molecular formula
C9H20N2
Molar mass
156.27 g/mol
Exact mass
156.1626 Da
Boiling point
85–89 °C (at 2 Torr)
logP
1.26Crippen estimate
Polar surface area
38.0 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
4

Identifiers

CAS number
3312-60-5
SMILES
NCCCNC1CCCCC1
InChIKey
ITZPOSYADVYECJ-UHFFFAOYSA-N
InChI
InChI=1S/C9H20N2/c10-7-4-8-11-9-5-2-1-3-6-9/h9,11H,1-8,10H2

Weigh it out

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

Names and synonyms

19 names · show all
  • 1,3-Propanediamine, N1-cyclohexyl-
  • 1,3-Propanediamine, N-cyclohexyl-
  • N1-Cyclohexyl-1,3-propanediamine
  • N-Cyclohexyl-1,3-propylenediamine
  • 1-(Cyclohexylamino)-3-aminopropane
  • N-(3-Aminopropyl)cyclohexylamine
  • 3-(Cyclohexylamino)-1-propylamine
  • N-Cyclohexyl-1,3-diaminopropane
  • 3-Amino-1-(cyclohexylamino)propane
  • N-Cyclohexyltrimethylenediamine
  • Polycat 352
  • (Cyclohexylamino)propylamine
  • N-(3-Aminopropyl)cyclohexanamine
  • Laromin C 252
  • N-(3-Aminopropyl)-N-cyclohexylamine
  • 3-(Cyclohexylamino)propylamine
  • NSC 87572
  • Baxxodur EC 252
  • EC 252

Work with N-Cyclohexyl-1,3-propanediamine

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-Piperidinemethanamine22990-77-856 % similar 2-(Cyclohexylamino)ethanol2842-38-856 % similar 2-Pyrrolidinemethanamine57734-57-352 % similar (S)-2-(Piperidin-2-yl)ethanol103639-57-248 % similar 2-Piperidineethanol1484-84-048 % similar Coniine3238-60-648 % similar Piperidine, 2-(2-propenyl)-, (S)- (9ci)133294-33-445 % similar 3-(Cyclohexylamino)propanenitrile702-03-445 % similar

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

Same formula

1-(3-Aminopropyl)-2-pipecoline25560-00-3 4-Amino-2,2,6,6-tetramethylpiperidine36768-62-4

Elsewhere

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