chempirical

1-Pyrrolidinepropanol

C7H15NOCAS 19748-66-4129.20 g/mol

Open in Covalent MOL file
HON
AlcoholTertiary amine

Properties

Molecular formula
C7H15NO
Molar mass
129.20 g/mol
Exact mass
129.1154 Da
Boiling point
98 °C (at 18 Torr)
logP
0.46Crippen estimate
Polar surface area
23.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Identifiers

CAS number
19748-66-4
SMILES
OCCCN1CCCC1
InChIKey
ZMJQROKRSPSLFH-UHFFFAOYSA-N
InChI
InChI=1S/C7H15NO/c9-7-3-6-8-4-1-2-5-8/h9H,1-7H2

Weigh it out

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

Names and synonyms

6 names
  • 3-(1-Pyrrolidyl)-1-propanol
  • 3-(1-Pyrrolidinyl)propanol
  • 3-Pyrrolidino-1-propanol
  • N-(3-Hydroxypropyl)pyrrolidine
  • 3-(Pyrrolidin-1-yl)propan-1-ol
  • 1-(3-Hydroxypropyl)pyrrolidine

Work with 1-Pyrrolidinepropanol

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-Piperidinepropanol104-58-593 % similar 1-Pyrrolidineethanol2955-88-675 % similar 1-Piperidineethanol3040-44-671 % similar 3-Morpholino-1-propanol4441-30-965 % similar 1-Piperazinepropanol5317-32-865 % similar 1-(3-Hydroxypropyl)-4-methylpiperazine5317-33-962 % similar 3-(Diethylamino)-1-propanol622-93-560 % similar Triethanolamine102-71-656 % 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-Methyl-2-piperidinemethanol20845-34-5 trans-4-(Methylamino)cyclohexanol22348-44-3

Elsewhere

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