(1S,2S)-2-(Phenylmethoxy)cyclohexanamine

C₁₃H₁₉NOCAS 216394-07-9205.30 g/mol

Open in Covalent MOL file

Ether Primary amine

Properties

Molecular formula: C₁₃H₁₉NO
Molar mass: 205.30 g/mol
Exact mass: 205.1467 Da
logP: 2.47Crippen estimate
Polar surface area: 35.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3
Stereocentres: S, Sin SMILES atom order

Identifiers

CAS number

216394-07-9

SMILES

N[C@H]1CCCC[C@@H]1OCc1ccccc1

InChIKey

NTHNRYLIXJZHRZ-STQMWFEESA-N

InChI

InChI=1S/C13H19NO/c14-12-8-4-5-9-13(12)15-10-11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,14H2/t12-,13-/m0/s1

Weigh it out

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

Names and synonyms

6 names

[(1S,2S)-2-(Benzyloxy)cyclohex-1-yl]amine
Cyclohexanamine, 2-(phenylmethoxy)-, (1S,2S)-
(1S,2S)-1-Amino-2-(Benzyloxy)cyclohexane
[(2S,1S)-2-(Benzyloxy)cyclohexyl]amine
[(1S,2S)-2-(Benzyloxy)cyclohexyl]amine
(1S,2S)-2-(Benzyloxy)cyclohexan-1-amine

Work with (1S,2S)-2-(Phenylmethoxy)cyclohexanamine

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

Same formula

3-[(3R,4R)-3,4-Dimethyl-4-piperidinyl]phenol119193-19-0 N,N-Bis(1-methylethyl)benzamide20383-28-2 (1R,2R)-2-(Phenylmethoxy)cyclohexanamine216394-06-8 1-(Phenylmethyl)-4-piperidinemethanol67686-01-5

Elsewhere

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