4-(Pyridin-3-yl)aniline

C11H10N2CAS 82261-42-5170.21 g/mol

Open in Covalent MOL file
NNH2
Primary amine

Properties

Molecular formula
C11H10N2
Molar mass
170.21 g/mol
Exact mass
170.0844 Da
logP
2.33Crippen estimate
Polar surface area
38.9 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
82261-42-5
SMILES
C1=CC(=CN=C1)C2=CC=C(C=C2)N
InChIKey
DKFDPLVNPGJNDE-UHFFFAOYSA-N
InChI
InChI=1S/C11H10N2/c12-11-5-3-9(4-6-11)10-2-1-7-13-8-10/h1-8H,12H2

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Names and synonyms

1 names
  • 4-(3-Pyridyl)aniline

Work with 4-(Pyridin-3-yl)aniline

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-Phenylpyridine1008-88-464 % similar 3-(4-Bromophenyl)pyridine129013-83-859 % similar 3-Aminopyridine462-08-858 % similar 4-Amino-P-terphenyl7293-45-056 % similar 4-Aminobiphenyl92-67-156 % similar 4,4',4''-Tris[(3-methylphenyl)phenylamino]triphenylamine921205-03-054 % similar 4-(Pyridin-3-yl)benzaldehyde127406-55-753 % similar B-[4-(3-Pyridinyl)phenyl]boronic acid170230-28-153 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(3-Cyanomethyl-5-methylphenyl)acetonitrile120511-74-2 6-Phenyl-3-pyridinamine126370-67-0 5-Phenyl-2-pyridinamine33421-40-8 1,2-Dimethyl-1H-indole-3-carbonitrile51072-84-5 N-2-Pyridylaniline6631-37-4

Elsewhere

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