4-(Hydroxymethyl)piperidin-4-ol

C₆H₁₃NO₂CAS 89584-31-6131.18 g/mol

Open in Covalent MOL file

Alcohol Secondary amine

Properties

Molecular formula: C₆H₁₃NO₂
Molar mass: 131.18 g/mol
Exact mass: 131.0946 Da
logP: -0.91Crippen estimate
Polar surface area: 52.5 Å²
H-bond donors / acceptors: 3 / 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

89584-31-6

SMILES

C1CNCCC1(CO)O

InChIKey

BCOGPFMRSSZIFM-UHFFFAOYSA-N

InChI

InChI=1S/C6H13NO2/c8-5-6(9)1-3-7-4-2-6/h7-9H,1-5H2

Weigh it out

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

Names and synonyms

1 names

4-Hydroxy-4-(hydroxymethyl)-piperidine hydrochloride

Work with 4-(Hydroxymethyl)piperidin-4-ol

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

4-(Phenylmethyl)-4-piperidinol51135-96-743 % similar 4-Methylpiperidin-4-ol3970-68-140 % similar 4,4-Dihydroxypiperidine hydrochloride40064-34-440 % similar 4-(Trifluoromethyl)-4-piperidinol373603-69-137 % similar 4-Methylpiperidin-4-ol hydrochloride586375-35-136 % similar 4,4-Difluoropiperidine21987-29-133 % similar 4-Hydroxy-4-phenylpiperidine40807-61-232 % similar 3-Azaspiro(5.5)undecane hydrochloride180-44-932 % similar

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

Same formula

Dimethylaminoethyl acetate1421-89-2 L-Alloisoleucine1509-34-8 D-Alloisoleucine1509-35-9 tert-Butyl methylcarbamate16066-84-5 L-tert-Leucine20859-02-3 N-Methyl-L-valine2480-23-1 D-tert-Leucine26782-71-8 D-Isoleucine319-78-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook