3-Iodopyridin-2-amine

C₅H₅IN₂CAS 104830-06-0220.01 g/mol

Open in Covalent MOL file

Aryl halide Primary amine

Properties

Molecular formula: C₅H₅IN₂
Molar mass: 220.01 g/mol
Exact mass: 219.9497 Da
logP: 1.27Crippen estimate
Polar surface area: 38.9 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed97.8% of notifiers
H312 Harmful in contact with skin10.9% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage87% of notifiers
H319 Causes serious eye irritation13% of notifiers
H332 Harmful if inhaled10.9% of notifiers
H335 May cause respiratory irritation97.8% of notifiers

Aggregated from 46 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, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

104830-06-0

SMILES

C1=CC(=C(N=C1)N)I

InChIKey

UUDNBWSHTUFGDQ-UHFFFAOYSA-N

InChI

InChI=1S/C5H5IN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)

Weigh it out

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

Names and synonyms

1 names

2-Amino-3-iodopyridine

Work with 3-Iodopyridin-2-amine

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

2-Amino-3-methylpyridine1603-40-356 % similar 2,3-Diaminopyridine452-58-454 % similar 2-Amino-3-bromopyridine13534-99-152 % similar 2-Fluoro-3-iodopyridine113975-22-750 % similar (3-Chloro-4-iodopyridin-2-yl)amine1152617-24-750 % similar 2-Amino-3-hydroxypyridine16867-03-150 % similar 2-Amino-3-fluoropyridine21717-95-350 % similar 2-Bromo-3-iodopyridine265981-13-350 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Iodopyridin-3-amine105752-11-2 2-Amino-5-iodopyridine20511-12-0 6-Iodopyridin-3-amine29958-12-1 4-Iodo-2-pyridinamine552331-00-7 3-Iodo-4-pyridinamine88511-27-7

Elsewhere

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