3-Benzyl-3,9-diaza-spiro[5.5]undecane

C₁₆H₂₄N₂CAS 189333-49-1244.38 g/mol

Open in Covalent MOL file

Secondary amine Tertiary amine

Properties

Molecular formula: C₁₆H₂₄N₂
Molar mass: 244.38 g/mol
Exact mass: 244.1939 Da
logP: 2.65Crippen estimate
Polar surface area: 15.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Identifiers

CAS number

189333-49-1

SMILES

C1CNCCC12CCN(CC2)CC3=CC=CC=C3

InChIKey

DKRVXLMWXJFVEJ-UHFFFAOYSA-N

InChI

InChI=1S/C16H24N2/c1-2-4-15(5-3-1)14-18-12-8-16(9-13-18)6-10-17-11-7-16/h1-5,17H,6-14H2

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

Names and synonyms

1 names

3-Benzyl-3,9-diazaspiro[5.5]undecane

Work with 3-Benzyl-3,9-diaza-spiro[5.5]undecane

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

1-Benzylpiperazine2759-28-667 % similar 4-Benzylpiperazine hydrochloride110475-31-561 % similar Benzylpiperazine dihydrochloride5321-63-161 % similar 1,4,7,10-Tetrabenzyl-1,4,7,10-tetraazacyclododecane18084-64-555 % similar 1-Benzylpiperidine2905-56-850 % similar 4-Hydroxy-1-(phenylmethyl)-4-piperidinecarbonitrile6094-60-649 % similar Tribenzylamine620-40-648 % similar 1-(2-Phenylethyl)piperazine5321-49-347 % similar

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

Same formula

Xylometazoline526-36-3 N,N-Dipropyltryptamine61-52-9

Elsewhere

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