chempirical

(3-Endo)-8-(1-methylethyl)-8-azabicyclo[3.2.1]octan-3-ol

C10H19NOCAS 3423-25-4169.27 g/mol

Open in Covalent MOL file
NOH
AlcoholTertiary amine

Properties

Molecular formula
C10H19NO
Molar mass
169.27 g/mol
Exact mass
169.1467 Da
logP
1.38Crippen estimate
Polar surface area
23.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1
Stereocentres
R, S, rin SMILES atom order

Identifiers

CAS number
3423-25-4
SMILES
CC(C)N1[C@@H]2CC[C@H]1C[C@@H](O)C2
InChIKey
YYDQYSQZIUSKFN-MYJAWHEDNA-N
InChI
InChI=1/C10H19NO/c1-7(2)11-8-3-4-9(11)6-10(12)5-8/h7-10,12H,3-6H2,1-2H3/t8-,9+,10+

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

Names and synonyms

6 names
  • 8-Azabicyclo[3.2.1]octan-3-ol, 8-(1-methylethyl)-, (3-endo)-
  • 1αH,5αH-Nortropan-3α-ol, 8-isopropyl-
  • 8-Azabicyclo[3.2.1]octan-3-ol, 8-(1-methylethyl)-, endo-
  • Nortropine, 8-isopropyl-
  • 8-Isopropylnortropan-3α-ol
  • N-Isopropylnortropine

Work with (3-Endo)-8-(1-methylethyl)-8-azabicyclo[3.2.1]octan-3-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

Tropine120-29-654 % similar Pseudotropine135-97-754 % similar 2,6-Dimethyl-4-heptanol108-82-740 % similar 3,5-Dimethylcyclohexanol5441-52-138 % similar 1,3,5-Cyclohexanetriol2041-15-836 % similar (2A,6A,8A,9Ab)-hexahydro-8-hydroxy-2,6-methano-2H-quinolizin-3(4H)-one115956-07-535 % similar 2,6,8-Trimethyl-4-nonanol123-17-133 % similar 4-Methylcyclohexanol589-91-333 % similar

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

Same formula

Lupinine486-70-4

Elsewhere

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