2-Benzyloxy-N-methoxy-N-methylbenzamide
PubChem CID: 29927969
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| Compound Synonyms | 873556-56-0, 2-Benzyloxy-N-methoxy-N-methylbenzamide, 2-BENZYLOXY-N-METHOXY-N-METHYL-BENZAMIDE, 2-(benzyloxy)-n-methoxy-n-methylbenzamide, SCHEMBL2290346, DTXSID60652261, AKOS015965196 |
|---|---|
| Topological Polar Surface Area | 38.8 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 20.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 302.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | N-methoxy-N-methyl-2-phenylmethoxybenzamide |
| Prediction Hob | 1.0 |
| Xlogp | 2.9 |
| Molecular Formula | C16H17NO3 |
| Prediction Swissadme | 0.0 |
| Inchi Key | ACWZSORVJMNLCV-UHFFFAOYSA-N |
| Fcsp3 | 0.1875 |
| Logs | -4.145 |
| Rotatable Bond Count | 5.0 |
| Logd | 4.206 |
| Compound Name | 2-Benzyloxy-N-methoxy-N-methylbenzamide |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 271.121 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 271.121 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 271.31 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.3908592000000004 |
| Inchi | InChI=1S/C16H17NO3/c1-17(19-2)16(18)14-10-6-7-11-15(14)20-12-13-8-4-3-5-9-13/h3-11H,12H2,1-2H3 |
| Smiles | CN(C(=O)C1=CC=CC=C1OCC2=CC=CC=C2)OC |
| Nring | 6.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Gentiana Macrophylla (Plant) Rel Props:Source_db:cmaup_ingredients