chempirical

1-Piperazinepropanol

C7H16N2OCAS 5317-32-8144.22 g/mol

Open in Covalent MOL file
HONNH
AlcoholSecondary amineTertiary amine

Properties

Molecular formula
C7H16N2O
Molar mass
144.22 g/mol
Exact mass
144.1263 Da
Melting point
200–215 °C
Boiling point
115–120 °C (at 0.7 Torr)
logP
-0.73Crippen estimate
Polar surface area
35.5 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
3

Identifiers

CAS number
5317-32-8
SMILES
OCCCN1CCNCC1
InChIKey
LWEOFVINMVZGAS-UHFFFAOYSA-N
InChI
InChI=1S/C7H16N2O/c10-7-1-4-9-5-2-8-3-6-9/h8,10H,1-7H2

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

Names and synonyms

8 names
  • 3-(1-Piperazinyl)-1-propanol
  • N-(3-Hydroxypropyl)piperazine
  • 1-(3-Hydroxypropyl)piperazine
  • 1-(3-Hydroxy-1-propyl)piperazine
  • 3-(1-Piperazinyl)propanol
  • 4-(3-Hydroxypropyl)piperazine
  • 1-(3-Hydroxypropyl)-4-piperazine
  • 3-(Piperazin-1-yl)propan-1-ol

Work with 1-Piperazinepropanol

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-Piperazineethanol103-76-471 % similar 1-Pyrrolidinepropanol19748-66-465 % similar 1-Piperidinepropanol104-58-562 % similar 1-[2-(1-Pyrrolidinyl)ethyl]piperazine22763-69-562 % similar 1-[2-(2-Hydroxyethoxy)ethyl]piperazine13349-82-156 % similar 3-Morpholino-1-propanol4441-30-952 % similar 1-Pyrrolidineethanol2955-88-650 % similar 1-(3-Hydroxypropyl)-4-methylpiperazine5317-33-950 % similar

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

Same formula

4-(3-Aminopropyl)morpholine123-00-2 4-(Aminomethyl)-1-methyl-4-piperidinol26228-68-2 3-(Diethylamino)propanamide3813-27-2 4-Methyl-1-piperazineethanol5464-12-0 (2S)-2-Amino-N,3,3-trimethylbutanamide89226-12-0

Elsewhere

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