1-(2-Aminoethyl)-2-imidazolidinone

C₅H₁₁N₃OCAS 6281-42-1129.16 g/mol

Open in Covalent MOL file

Primary amine

Properties

Molecular formula: C₅H₁₁N₃O
Molar mass: 129.16 g/mol
Exact mass: 129.0902 Da
Boiling point: 155–163 °C (at 1 Torr)
logP: -0.83Crippen estimate
Polar surface area: 61.9 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Hazards

Danger

H314 Causes severe skin burns and eye damage99.5% of notifiers
H317 May cause an allergic skin reaction80.1% of notifiers
H318 Causes serious eye damage99.5% of notifiers

Aggregated from 553 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P261, P264, P264+P265, P272, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P333+P317, P362+P364, P363, P405, P501

Identifiers

CAS number

6281-42-1

SMILES

NCCN1CCN=C1O

InChIKey

PODSUMUEKRUDEI-UHFFFAOYSA-N

InChI

InChI=1S/C5H11N3O/c6-1-3-8-4-2-7-5(8)9/h1-4,6H2,(H,7,9)

Weigh it out

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

Names and synonyms

16 names · show all

2-Imidazolidinone, 1-(2-aminoethyl)-
1-(β-Aminoethyl)-2-imidazolidone
1-(2-Aminoethyl)-2-imidazolidone
1-(2-Aminoethyl)imidazolidinone
N-(2-Aminoethyl)ethyleneurea
N-(β-Aminoethyl)-N,N′-ethyleneurea
N-(2-Aminoethyl)imidazolidinone
2-(2-Oxoimidazolidin-1-yl)ethylamine
3-(2-Aminoethyl)-2-imidazolidinone
[2-(2-Oxoimidazolidino)ethyl]amine
NSC 5776
3-(2-Aminoethyl)-2-imidazolidone
N-(2-Aminoethyl)imidazolidin-2-one
N-(2-Aminoethyl)imidazolidone
Reverlink U
1-(2-Aminoethyl)imidazolidone

Work with 1-(2-Aminoethyl)-2-imidazolidinone

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

1-(2-Hydroxyethyl)-2-imidazolidinone3699-54-561 % similar 2-Oxo-1-imidazolidinecarbonyl chloride13214-53-437 % similar 1-Acetyl-2-imidazolidinone5391-39-937 % similar 1-(Methylsulfonyl)-2-imidazolidinone41730-79-436 % similar Cyclocreatine35404-50-335 % similar Carmustine154-93-831 % similar Tris(2-aminoethyl)amine4097-89-631 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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