(S)-3-Hydroxypiperidine hydrochloride

C5H12ClNOCAS 475058-41-4137.61 g/mol

Open in Covalent MOL file
HNOHHCl
AlcoholSecondary amine

Properties

Molecular formula
C5H12ClNO
Molar mass
137.61 g/mol
Exact mass
137.0607 Da
logP
0.15Crippen estimate
Polar surface area
32.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0
Stereocentres
Sin SMILES atom order

Hazards

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

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Identifiers

CAS number
475058-41-4
SMILES
C1C[C@@H](CNC1)O.Cl
InChIKey
VLECDMDGMKPUSK-JEDNCBNOSA-N
InChI
InChI=1S/C5H11NO.ClH/c7-5-2-1-3-6-4-5;/h5-7H,1-4H2;1H/t5-;/m0./s1

Weigh it out

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

Work with (S)-3-Hydroxypiperidine 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

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.

3-Hydroxypiperidine6859-99-0Free base, stereo not defined (R)-3-Hydroxypiperidine hydrocloride198976-43-1Enantiomer 3-Hydroxypiperidine hydrochloride64051-79-2Stereo not defined

Similar compounds

(R)-(-)-3-Pyrrolidinol hydrochloride104706-47-074 % similar (S)-3-Hydroxypyrrolidine hydrochloride122536-94-174 % similar 3-Hydroxypyrrolidine hydrochloride86070-82-874 % similar (+)-3-Pyrrolidinol100243-39-861 % similar (-)-3-Pyrrolidinol2799-21-561 % similar 3-Pyrrolidinol40499-83-061 % similar 3-Hydroxyazetidine hydrochloride18621-18-657 % similar 4-Hydroxypiperidinium chloride5382-17-252 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(3S)-3-Methylmorpholine hydrochloride1022094-03-6 (2S)-2-Methylmorpholine hydrochloride1147108-99-3 (1R,3S)-3-Aminocyclopentanol hydrochloride1279032-31-3 (1R,2S)-2-Aminocyclopentanol hydrochloride137254-03-6 1,4-Oxazepane hydrochloride178312-62-4 (Tetrahydrofuran-3-yl)methanamine hydrochloride184950-35-4 cis-(1S,2R)-2-Aminocyclopentanol hydrochloride225791-13-9

Elsewhere

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