N-(4-Hydroxyphenyl)-2-methylbenzamide
PubChem CID: 576961
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| Compound Synonyms | N-(4-Hydroxyphenyl)-2-methylbenzamide, 22978-52-5, Benzamide, N-(4-hydroxyphenyl)-2-methyl-, o-Toluanilide, 4'-hydroxy-, Oprea1_319297, Oprea1_399909, 2-Methyl-4'-hydroxybenzanilide, SCHEMBL11781486, 2-methyl-4'-hydroxy-benzanilide, DTXSID40341924, OGBLLVHAQZADRR-UHFFFAOYSA-N, AKOS003610876, N-(4-Hydroxyphenyl)-2-methylbenzamide #, N-(4-HYDROXY-PHENYL)-2-METHYL-BENZAMIDE, AN-652/40051290 |
|---|---|
| Topological Polar Surface Area | 49.3 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 17.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 259.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | N-(4-hydroxyphenyl)-2-methylbenzamide |
| Prediction Hob | 1.0 |
| Xlogp | 2.5 |
| Molecular Formula | C14H13NO2 |
| Prediction Swissadme | 0.0 |
| Inchi Key | OGBLLVHAQZADRR-UHFFFAOYSA-N |
| Fcsp3 | 0.0714285714285714 |
| Logs | -3.341 |
| Rotatable Bond Count | 2.0 |
| Logd | 2.914 |
| Compound Name | N-(4-Hydroxyphenyl)-2-methylbenzamide |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 227.095 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 227.095 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 227.26 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.1672835411764706 |
| Inchi | InChI=1S/C14H13NO2/c1-10-4-2-3-5-13(10)14(17)15-11-6-8-12(16)9-7-11/h2-9,16H,1H3,(H,15,17) |
| Smiles | CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)O |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Illicium Verum (Plant) Rel Props:Source_db:cmaup_ingredients