(Hexahydro-1H-azepin-1-yl)-3-piperidinylmethanone

C₁₂H₂₂N₂OCAS 690632-28-1210.32 g/mol

Open in Covalent MOL file

Amide Secondary Amine

Properties

Molecular formula: C₁₂H₂₂N₂O
Molar mass: 210.32 g/mol
Exact mass: 210.1732 Da
logP: 1.39Crippen estimate
Polar surface area: 32.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

690632-28-1

SMILES

O=C(C1CCCNC1)N1CCCCCC1

InChIKey

RXLCUJOYUJWMPG-UHFFFAOYSA-N

InChI

InChI=1S/C12H22N2O/c15-12(11-6-5-7-13-10-11)14-8-3-1-2-4-9-14/h11,13H,1-10H2

Weigh it out

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

Names and synonyms

4 names

Methanone, (hexahydro-1H-azepin-1-yl)-3-piperidinyl-
1H-Azepine, hexahydro-1-(3-piperidinylcarbonyl)-
1-Azepanyl(3-piperidinyl)methanone
1-(Piperidine-3-carbonyl)azepane

Work with (Hexahydro-1H-azepin-1-yl)-3-piperidinylmethanone

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

Elsewhere

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