2,3-Naphthalenedicarboxamide
PubChem CID: 5102564
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| Compound Synonyms | Naphthalene-2,3-dicarboxamide, 2,3-Naphthalenedicarboxamide, 106733-12-4, 2 3-NAPHTHALENEDICARBOXAMIDE 95, DTXSID40408344, SCHEMBL1004596, DTXCID50359196 |
|---|---|
| Topological Polar Surface Area | 86.2 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 16.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 273.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | naphthalene-2,3-dicarboxamide |
| Prediction Hob | 1.0 |
| Xlogp | 0.9 |
| Molecular Formula | C12H10N2O2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | OABIEOPOGPOCJL-UHFFFAOYSA-N |
| Fcsp3 | 0.0 |
| Logs | -3.238 |
| Rotatable Bond Count | 2.0 |
| Logd | 1.052 |
| Compound Name | 2,3-Naphthalenedicarboxamide |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 214.074 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 214.074 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 214.22 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.1114888 |
| Inchi | InChI=1S/C12H10N2O2/c13-11(15)9-5-7-3-1-2-4-8(7)6-10(9)12(14)16/h1-6H,(H2,13,15)(H2,14,16) |
| Smiles | C1=CC=C2C=C(C(=CC2=C1)C(=O)N)C(=O)N |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Commelina Communis (Plant) Rel Props:Source_db:cmaup_ingredients