Ropivacaine hydrochloride

C₁₇H₂₇ClN₂OCAS 98717-15-8310.87 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₇H₂₇ClN₂O
Molar mass: 310.87 g/mol
Exact mass: 310.1812 Da
Melting point: 260–262 °C
logP: 4.58Crippen estimate
Polar surface area: 35.8 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 4
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

98717-15-8

SMILES

CCCN1CCCC[C@H]1C(O)=Nc1c(C)cccc1C.Cl

InChIKey

NDNSIBYYUOEUSV-RSAXXLAASA-N

InChI

InChI=1S/C17H26N2O.ClH/c1-4-11-19-12-6-5-10-15(19)17(20)18-16-13(2)8-7-9-14(16)3;/h7-9,15H,4-6,10-12H2,1-3H3,(H,18,20);1H/t15-;/m0./s1

Weigh it out

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

Names and synonyms

5 names

2-Piperidinecarboxamide, N-(2,6-dimethylphenyl)-1-propyl-, hydrochloride (1:1), (2S)-
2-Piperidinecarboxamide, N-(2,6-dimethylphenyl)-1-propyl-, monohydrochloride, (S)-
2-Piperidinecarboxamide, N-(2,6-dimethylphenyl)-1-propyl-, monohydrochloride, (2S)-
AL 381
Naropin

Work with Ropivacaine hydrochloride

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

Ropivacaine hydrochloride monohydrate132112-35-793 % similar Ropivacaine84057-95-493 % similar (+)-Ropivacaine98717-16-993 % similar Bupivacaine hydrochloride14252-80-391 % similar Bupivacaine hydrochloride18010-40-791 % similar (-)-Bupivacaine monohydrochloride27262-48-291 % similar Bupivacaine2180-92-984 % similar (-)-Bupivacaine27262-47-184 % similar

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

Elsewhere

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