Ramiprilat

C₂₁H₂₈N₂O₅CAS 87269-97-4388.46 g/mol

Open in Covalent MOL file

Amide Carboxylic acid Secondary amine

Properties

Molecular formula: C₂₁H₂₈N₂O₅
Molar mass: 388.46 g/mol
Exact mass: 388.1998 Da
Melting point: 109 °C
logP: 1.90Crippen estimate
Polar surface area: 106.9 Å²
H-bond donors / acceptors: 3 / 4
Rotatable bonds: 8
Stereocentres: S, S, S, S, Sin SMILES atom order

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
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, 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

87269-97-4

SMILES

C[C@H](N[C@@H](CCc1ccccc1)C(=O)O)C(=O)N1[C@H](C(=O)O)C[C@@H]2CCC[C@@H]21

InChIKey

KEDYTOTWMPBSLG-HILJTLORSA-N

InChI

InChI=1S/C21H28N2O5/c1-13(22-16(20(25)26)11-10-14-6-3-2-4-7-14)19(24)23-17-9-5-8-15(17)12-18(23)21(27)28/h2-4,6-7,13,15-18,22H,5,8-12H2,1H3,(H,25,26)(H,27,28)/t13-,15-,16-,17-,18-/m0/s1

Weigh it out

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

Names and synonyms

6 names

Cyclopenta[b]pyrrole-2-carboxylic acid, 1-[(2S)-2-[[(1S)-1-carboxy-3-phenylpropyl]amino]-1-oxopropyl]octahydro-, (2S,3aS,6aS)-
Cyclopenta[b]pyrrole-2-carboxylic acid, 1-[2-[(1-carboxy-3-phenylpropyl)amino]-1-oxopropyl]octahydro-, [2S-[1[R*(R*)],2α,3aβ,6aβ]]-
(2S,3aS,6aS)-1-[(2S)-2-[[(1S)-1-Carboxy-3-phenylpropyl]amino]-1-oxopropyl]octahydrocyclopenta[b]pyrrole-2-carboxylic acid
HOE 498 diacid
Ramipril diacid
Ramiprilate

Work with Ramiprilat

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

Ramipril87333-19-579 % similar Trandolapril87679-37-676 % similar Perindoprilat95153-31-470 % similar Enalaprilat76420-72-966 % similar N-[(1S)-1-Carboxy-3-phenylpropyl]-L-alanyl-L-proline hydrate (1:2)84680-54-663 % similar Perindopril82834-16-057 % similar Enalapril75847-73-353 % similar Perindopril erbumine107133-36-851 % similar

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

Same formula

Donormil562-10-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook