2-Aminopropanediamide

C₃H₇N₃O₂CAS 62009-47-6117.11 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₃H₇N₃O₂
Molar mass: 117.11 g/mol
Exact mass: 117.0538 Da
Melting point: 196 °C
logP: -0.62Crippen estimate
Polar surface area: 114.2 Å²
H-bond donors / acceptors: 5 / 3
Rotatable bonds: 2

Hazards

Warning

H302 Harmful if swallowed50% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

62009-47-6

SMILES

N=C(O)C(N)C(=N)O

InChIKey

GFQBSQXXHYLABK-UHFFFAOYSA-N

InChI

InChI=1S/C3H7N3O2/c4-1(2(5)7)3(6)8/h1H,4H2,(H2,5,7)(H2,6,8)

Weigh it out

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

Names and synonyms

5 names

Propanediamide, 2-amino-
Malonamide, 2-amino-
Aminomalonamide
NSC 75208
2-Aminomalonamide

Work with 2-Aminopropanediamide

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

L-Alaninamide hydrochloride33208-99-044 % similar 2-Amino-2-cyanoacetamide6719-21-744 % similar 2,2-Difluoroacetamide359-38-643 % similar Isobutyramide563-83-743 % similar Cyclopropanecarboxamide6228-73-543 % similar Dichloroacetamide683-72-743 % similar L-Serinamide hydrochloride65414-74-641 % similar D-Phenylglycine amide6485-67-239 % similar

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

Same formula

Glycocyamine352-97-6 ENU759-73-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook