chempirical

1-Pyridin-2-yl-ethylamine

C7H10N2CAS 42088-91-5122.17 g/mol

Open in Covalent MOL file
NH2N
Primary amine

Properties

Molecular formula
C7H10N2
Molar mass
122.17 g/mol
Exact mass
122.0844 Da
logP
1.10Crippen estimate
Polar surface area
38.9 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Identifiers

CAS number
42088-91-5
SMILES
CC(C1=CC=CC=N1)N
InChIKey
PDNHLCRMUIGNBV-UHFFFAOYSA-N
InChI
InChI=1S/C7H10N2/c1-6(8)7-4-2-3-5-9-7/h2-6H,8H2,1H3

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Names and synonyms

1 names
  • 1-(Pyridin-2-yl)ethan-1-amine

Work with 1-Pyridin-2-yl-ethylamine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

(S)-1-Pyridin-2-yl-ethylamine45695-03-2Defined stereoisomer

Similar compounds

(R)-2-(1-Hydroxyethyl)pyridine27911-63-353 % similar (S)-1-Phenylethylamine2627-86-346 % similar (+)-Phenylethylamine3886-69-946 % similar 1-Phenylethylamine618-36-046 % similar 1-Phenylethylamine98-84-046 % similar α-Methyl-3-pyridinemethanamine56129-55-642 % similar α-Phenyl-2-pyridineacetonitrile5005-36-740 % similar 2-Isobutylpyridine6304-24-139 % similar

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

Same formula

2,4-Dimethylpyridin-3-amine1073-21-8 4-Dimethylaminopyridine1122-58-3 4,6-Dimethyl-3-pyridinamine1193-71-1 4-Pyridineethanamine13258-63-4 2-Ethyl-5-methylpyrazine13360-64-0 2,3,5-Trimethylpyrazine14667-55-1 3-Methyl-2-pyridinemethanamine153936-26-6 2-Ethyl-3-methylpyrazine15707-23-0

Elsewhere

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