3-(1H-Pyrazol-3-yl)pyridine

C8H7N3CAS 45887-08-9145.16 g/mol

Open in Covalent MOL file
NNHN

Properties

Molecular formula
C8H7N3
Molar mass
145.16 g/mol
Exact mass
145.0640 Da
logP
1.47Crippen estimate
Polar surface area
41.6 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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
45887-08-9
SMILES
C1=CC(=CN=C1)C2=CC=NN2
InChIKey
JJLMOUMOJSUSSX-UHFFFAOYSA-N
InChI
InChI=1S/C8H7N3/c1-2-7(6-9-4-1)8-3-5-10-11-8/h1-6H,(H,10,11)

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Names and synonyms

1 names
  • 3-(1H-Pyrazol-5-yl)pyridine

Work with 3-(1H-Pyrazol-3-yl)pyridine

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

3-Phenylpyridine1008-88-450 % similar Pyridine, 3-(1H-1,2,3-triazol-4-yl)- (9ci)120241-79-448 % similar 3-(4-Fluorophenyl)-1H-pyrazole154258-82-947 % similar 3-(4-Chlorophenyl)-1H-pyrazole59843-58-247 % similar 3-(4-Bromophenyl)-1H-pyrazole73387-46-947 % similar 4,4',4''-Tris[(3-methylphenyl)phenylamino]triphenylamine921205-03-047 % similar 3-(2H-Pyrazol-3-yl)benzonitrile149739-51-546 % similar 3-(2H-Tetrazol-5-yl)pyridine3250-74-643 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,7-Naphthyridin-8-amine17965-82-1 2-(1H-Imidazol-2-yl)-pyridine18653-75-3 Diiminoisoindole3468-11-9 3-(1H-Imidazol-5-yl)pyridine51746-85-1 1,3-Diiminoisoindoline57500-34-2 6-Aminoquinoxaline6298-37-9 2-(1H-Pyrazol-3-yl)pyridine75415-03-1

Elsewhere

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