Nortropine
PubChem CID: 73480
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | Nortropine, 538-09-0, exo-8-Azabicyclo[3.2.1]octan-3-ol, (1R,3R,5S)-8-azabicyclo[3.2.1]octan-3-ol, 501-33-7, Nortropenol, (1S,5R)-8-AZABICYCLO[3.2.1]OCTAN-3-OL, (3-endo)-8-Azabicyclo[3.2.1]octan-3-ol, (1r,5s)-8-azabicyclo[3.2.1]octan-3-ol, DTXSID701318429, 8-Azabicyclo(3.2.1)octan-3-ol, endo-, Nortropidine, 2,3-dihydro-3-hydroxy-, 1alpha-H,5alpha-H-Nortropan-3alpha-ol, Nortropeno Hydrochloride, (1R,3S,5S)-8-AZABICYCLO[3.2.1]OCTAN-3-OL, MFCD00047140, NSC 72850, 1alphaH,5alphaH-Nortropan-3alpha-ol, Nortropan-3.beta.-ol, 1-alpha-H,5-alpha-H-Nortropan-3-alpha-ol, SCHEMBL1023891, SCHEMBL1023893, SCHEMBL20310206, YYMCYJLIYNNOMK-KVSKUHBBSA-N, YYMCYJLIYNNOMK-MEKDEQNOSA-N, DTXCID301748240, 8-Azabicyclo-3.2.1-octan-3-ol, AC-656, BBL102830, CCG-36431, STL556638, AKOS006344688, AKOS006349303, AKOS025310532, CS-W019387, FN26478, HY-W018601, DS-16717, CS-0055140, EN300-131843, EN300-218694, P10202 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 32.299 |
| Hydrogen Bond Donor Count | 2.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | C1CC2CCC(C1)C2 |
| Np Classifier Class | Tropane alkaloids |
| Deep Smiles | OCC[C@@H]CC[C@H]C7)N5 |
| Heavy Atom Count | 9.0 |
| Classyfire Class | Tropane alkaloids |
| Scaffold Graph Node Level | C1CC2CCC(C1)N2 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 103.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Iupac Name | (1R,5S)-8-azabicyclo[3.2.1]octan-3-ol |
| Veber Rule | True |
| Classyfire Superclass | Alkaloids and derivatives |
| Xlogp | 0.3 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C7H13NO |
| Scaffold Graph Node Bond Level | C1CC2CCC(C1)N2 |
| Inchi Key | YYMCYJLIYNNOMK-MEKDEQNOSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 0.0 |
| Synonyms | nortropine |
| Esol Class | Very soluble |
| Functional Groups | CNC, CO |
| Compound Name | Nortropine |
| Exact Mass | 127.1 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 127.1 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 127.18 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C7H13NO/c9-7-3-5-1-2-6(4-7)8-5/h5-9H,1-4H2/t5-,6+,7? |
| Smiles | C1C[C@H]2CC(C[C@@H]1N2)O |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Ornithine alkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Datura Innoxia (Plant) Rel Props:Reference:ISBN:9788172360481 - 2. Outgoing r'ship
FOUND_INto/from Duboisia Myoporoides (Plant) Rel Props:Reference:ISBN:9788172360481