D-Cyclopropylglycine

C₅H₉NO₂CAS 49607-01-4115.13 g/mol

Open in Covalent MOL file

Carboxylic acid Primary amine

Properties

Molecular formula: C₅H₉NO₂
Molar mass: 115.13 g/mol
Exact mass: 115.0633 Da
logP: -0.19Crippen estimate
Polar surface area: 63.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2
Stereocentres: Rin SMILES atom order

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

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

Identifiers

CAS number

49607-01-4

SMILES

C1CC1[C@H](C(=O)O)N

InChIKey

BUSBCPMSNBMUMT-SCSAIBSYSA-N

InChI

InChI=1S/C5H9NO2/c6-4(5(7)8)3-1-2-3/h3-4H,1-2,6H2,(H,7,8)/t4-/m1/s1

Weigh it out

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

Names and synonyms

1 names

(R)-Amino cyclopropyl acetic acid

Work with D-Cyclopropylglycine

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.

L-Cyclopropylglycine49606-99-7Enantiomer

Similar compounds

(αS)-α-Aminocyclopentaneacetic acid2521-84-883 % similar (αR)-α-Aminocyclopentaneacetic acid2521-86-083 % similar α-Aminocyclobutaneacetic acid28024-69-383 % similar (2R)-2-Amino-2-cyclobutylacetic acid49607-10-583 % similar (αS)-α-Aminocyclohexaneacetic acid14328-51-979 % similar D-Alpha-cyclohexylglycine14328-52-079 % similar Amino-cyclohexyl-acetic acid5664-29-979 % similar 4'-Tetrahydropyranylglycine53284-84-773 % similar

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

Same formula

N-Methyldiacetamide1113-68-4 1-(3-Hydroxy-1-azetidinyl)ethanone118972-96-6 Methyl 3-amino-2-butenoate14205-39-1 Proline147-85-3 N-(Hydroxymethyl)-2-pyrrolidone15438-71-8 s-Allylglycine16338-48-0 (5S)-5-(Hydroxymethyl)-2-pyrrolidinone17342-08-4 N-Methylacetoacetamide20306-75-6

Elsewhere

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