chempirical

Nortropine

C7H13NOCAS 538-09-0127.19 g/mol

Open in Covalent MOL file
OHNH
AlcoholSecondary amine

Properties

Molecular formula
C7H13NO
Molar mass
127.19 g/mol
Exact mass
127.0997 Da
Melting point
161 °C
logP
0.26Crippen estimate
Polar surface area
32.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0
Stereocentres
r, R, Sin SMILES atom order

Identifiers

CAS number
538-09-0
SMILES
O[C@H]1C[C@H]2CC[C@@H](C1)N2
InChIKey
YYMCYJLIYNNOMK-ZMONIFLSNA-N
InChI
InChI=1/C7H13NO/c9-7-3-5-1-2-6(4-7)8-5/h5-9H,1-4H2/t5-,6+,7+

Weigh it out

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

Names and synonyms

12 names
  • 8-Azabicyclo[3.2.1]octan-3-ol, (3-endo)-
  • 1αH,5αH-Nortropan-3α-ol
  • 8-Azabicyclo[3.2.1]octan-3-ol, endo-
  • (3-Endo)-8-Azabicyclo[3.2.1]octan-3-ol
  • Tropigenine
  • Tropigenin
  • Nortropin
  • Nortropenol
  • NSC 72850
  • N-Demethyltropine
  • endo-8-Azabicyclo[3.2.1]octan-3-ol
  • 3α-Nortropanol

Work with Nortropine

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

Nortropine hydrochloride14383-51-884 % similar 1,3,5-Cyclohexanetriol2041-15-847 % similar trans-4-(Methylamino)cyclohexanol22348-44-342 % similar Cyclopropanol16545-68-939 % similar 1,4-Cyclohexanediol556-48-939 % similar trans-1,4-Cyclohexanediol6995-79-539 % similar 1,3-Cyclohexanediol504-01-838 % similar 2,6-Dimethyl-4-heptanol108-82-736 % similar

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

Same formula

tert-Butylacrylamide107-58-4 Cyclohexanecarboxamide1122-56-1 N-Isopropylmethacrylamide13749-61-6 (±)-3-Quinuclidinol1619-34-7 1-Aza-2-methoxy-1-cycloheptene2525-16-8 Hexyl isocyanate2525-62-4 (R)-3-Quinuclidinol25333-42-0 N-Methylcaprolactam2556-73-2

Elsewhere

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