chempirical

Isopropyl 4-hydroxypiperidine-1-carboxylate

C9H17NO3CAS 832715-51-2187.24 g/mol

Open in Covalent MOL file
OONOH
AlcoholCarbamate

Properties

Molecular formula
C9H17NO3
Molar mass
187.24 g/mol
Exact mass
187.1208 Da
logP
0.99Crippen estimate
Polar surface area
49.8 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
832715-51-2
SMILES
CC(C)OC(=O)N1CCC(CC1)O
InChIKey
UKVIBHRSFKWRPA-UHFFFAOYSA-N
InChI
InChI=1S/C9H17NO3/c1-7(2)13-9(12)10-5-3-8(11)4-6-10/h7-8,11H,3-6H2,1-2H3

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Work with Isopropyl 4-hydroxypiperidine-1-carboxylate

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

Ethyl 4-hydroxy-1-piperidinecarboxylate65214-82-660 % similar tert-Butyl 4-hydroxypiperidine-1-carboxylate109384-19-258 % similar tert-Butyl 4-hydroxyazepane-1-carboxylate478832-21-253 % similar 1-Acetylpiperidin-4-ol4045-22-150 % similar N-(Benzyloxycarbonyl)-4-hydroxypiperidine95798-23-548 % similar (R)-(-)-1-CBZ-3-pyrrolidinol100858-33-139 % similar (R)-1-Boc-3-hydroxypiperidine143900-43-039 % similar (S)-1-Boc-3-hydroxypiperidine143900-44-139 % similar

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

Same formula

(S)-3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester101469-92-5 3-Hydroxypyrrolidine-1-carboxylic acid tert-butyl ester103057-44-9 tert-Butyl N-(1-(hydroxymethyl)cyclopropyl)carbamate107017-73-2 tert-Butyl (3R)-3-hydroxypyrrolidine-1-carboxylate109431-87-0 3-Hydroxy-3-methyl-azetidine-1-carboxylic acid tert-butyl ester1104083-23-9 1-Boc-azetidine-3-ylmethanol142253-56-3 tert-Butyl (2S)-2-(hydroxymethyl)azetidine-1-carboxylate161511-85-9 tert-Butyl 2-(hydroxymethyl)azetidine-1-carboxylate174346-82-8

Elsewhere

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