5-Amino-1H-pyrazole-1-ethanol

C5H9N3OCAS 73616-27-0127.15 g/mol

Open in Covalent MOL file
H2NNNHO
AlcoholPrimary amine

Properties

Molecular formula
C5H9N3O
Molar mass
127.15 g/mol
Exact mass
127.0746 Da
Melting point
108–109 °C
Boiling point
133–140 °C (at 0.04 Torr)
logP
-0.54Crippen estimate
Polar surface area
64.1 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
73616-27-0
SMILES
Nc1ccnn1CCO
InChIKey
IHQRJCVJAUKIEP-UHFFFAOYSA-N
InChI
InChI=1S/C5H9N3O/c6-5-1-2-7-8(5)3-4-9/h1-2,9H,3-4,6H2

Weigh it out

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Names and synonyms

7 names
  • 1H-Pyrazole-1-ethanol, 5-amino-
  • Pyrazole-1-ethanol, 5-amino-
  • 5-Amino-1-(2-hydroxyethyl)pyrazole
  • NSC 267219
  • 2-(5-Amino-1H-pyrazol-1-yl)ethanol
  • 2-(5-Amino-1H-pyrazol-1-yl)ethan-1-ol
  • 2-(5-Aminopyrazol-1-yl)ethanol

Work with 5-Amino-1H-pyrazole-1-ethanol

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

5-Amino-1-ethylpyrazole3528-58-355 % similar 1-((4-Methoxyphenyl)methyl)-1H-pyrazol-5-amine3528-45-843 % similar 1-Methyl-1H-pyrazol-5-amine1192-21-841 % similar 4,5-Diamino-1-(2-hydroxyethyl)pyrazole sulfate155601-30-240 % similar 2-(5-Mercaptotetrazole-1-yl)ethanol56610-81-236 % similar 2-Methyl-1H-imidazole-1-ethanol1615-15-232 % similar Imidazole-1-ethanol1615-14-131 % similar Carbazole-9-ethanol1484-14-631 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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