Enalapril maleate

C₂₄H₃₂N₂O₉CAS 76095-16-4492.53 g/mol

Open in Covalent MOL file

Alkene Amide Carboxylic acid Ester Secondary amine

Properties

Molecular formula: C₂₄H₃₂N₂O₉
Molar mass: 492.53 g/mol
Exact mass: 492.2108 Da
Melting point: 143–144.5 °C
logP: 1.32Crippen estimate
Polar surface area: 170.5 Å²
H-bond donors / acceptors: 4 / 7
Rotatable bonds: 11
Stereocentres: S, S, Sin SMILES atom order
Double bonds: ZE/Z, in SMILES order

Hazards

Danger

H302 Harmful if swallowed19.3% of notifiers
H318 Causes serious eye damage46% of notifiers
H319 Causes serious eye irritation23.3% of notifiers
H360 May damage fertility or the unborn child24.3% of notifiers
H361 Suspected of damaging fertility or the unborn child36.1% of notifiers
H362 May cause harm to breast-fed children14.4% of notifiers
H372 Causes damage to organs through prolonged or repeated exposure18.3% of notifiers

Aggregated from 202 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P260, P263, P264, P264+P265, P270, P280, P301+P317, P305+P351+P338, P305+P354+P338, P317, P318, P319, P330, P337+P317, P405, P501

Identifiers

CAS number

76095-16-4

SMILES

CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N2CCC[C@H]2C(=O)O.C(=C\C(=O)O)\C(=O)O

InChIKey

OYFJQPXVCSSHAI-QFPUQLAESA-N

InChI

InChI=1S/C20H28N2O5.C4H4O4/c1-3-27-20(26)16(12-11-15-8-5-4-6-9-15)21-14(2)18(23)22-13-7-10-17(22)19(24)25;5-3(6)1-2-4(7)8/h4-6,8-9,14,16-17,21H,3,7,10-13H2,1-2H3,(H,24,25);1-2H,(H,5,6)(H,7,8)/b;2-1-/t14-,16-,17-;/m0./s1

Weigh it out

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

Names and synonyms

63 names · show all

L-Proline, N-[(1S)-1-(ethoxycarbonyl)-3-phenylpropyl]-L-alanyl-, (2Z)-2-butenedioate (1:1)
L-Proline, 1-[N-[1-(ethoxycarbonyl)-3-phenylpropyl]-L-alanyl]-, (S)-, (Z)-2-butenedioate (1:1)
MK 421 maleate
MK 421
Vasotec
Pressotec
Xanef
Enapren
Biocronil
Renitec
Pres
Elfonal
Vasopril
Invoril
Innovace
Enaril
Minipril
Kenopril
Inoprilat
Unaril
Envas
Enaprin
Analept
Sintec
Naprilene
Alphrin
Lotrial
BQL
Tenace
Acetensil
Convertin
Repantril
Amprace
Renitek
Nuril
Hytrol
Enaloc
Enaladil
Benalipril
Unipril
Controlvas
Lapril
Innovade
Ednyt
Reniten
Renavace
Naritec
Presil
Glioten
Converten
Renivace
Enapril
Enacard
Olivin
Hipoartel
Cardiovet
Bitensil
Antiprex
Enace
Ezapril
Acapril
ENAP
Enalapril LPH

Work with Enalapril maleate

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.

Fumaric acid110-17-8Free acid, diastereomer Maleic acid110-16-7Free acid, stereo not defined Poly(maleic acid)26099-09-2Free acid, stereo not defined Enalapril75847-73-3Free base Iron(II) fumarate141-01-5Salt, diastereomer Pyrilamine maleate59-33-6Salt, stereo not defined Chlorpheniramine maleate113-92-8Salt, stereo not defined Timolol maleate26921-17-5Salt Sodium fumarate5873-57-4Salt, diastereomer Clemastine fumarate14976-57-9Salt, diastereomer Calcium fumarate19855-56-2Salt, diastereomer (±)-Brompheniramine maleate980-71-2Salt, stereo not defined

Similar compounds

Quinapril85441-61-869 % similar Enalaprilat76420-72-969 % similar Quinapril hydrochloride82586-55-867 % similar N-[(1S)-1-Carboxy-3-phenylpropyl]-L-alanyl-L-proline hydrate (1:2)84680-54-666 % similar Cilazapril88768-40-565 % similar Ramipril87333-19-564 % similar Trandolapril87679-37-664 % similar Moexipril103775-10-663 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook