N-Methylhomoveratrylamine
PubChem CID: 77039
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| Compound Synonyms | N-Methylhomoveratrylamine, 3490-06-0, 2-(3,4-Dimethoxyphenyl)-N-methylethylamine, 2-(3,4-dimethoxyphenyl)-N-methylethanamine, 3,4-Dimethoxy-N-methylphenethylamine, UNII-5H5ZH95EHG, Benzeneethanamine, 3,4-dimethoxy-N-methyl-, 5H5ZH95EHG, EINECS 222-483-9, NSC 187772, NSC-187772, 2-(3,4-DIMETHOXYPHENYL)-N-METHYLETHAN-1-AMINE, DTXSID70188460, EC 222-483-9, N-Methyl-2-(3,4-dimethoxyphenyl)ethylamine, N-(3,4-DIMETHOXYPHENETHYL)-N-METHYLAMINE, 2-(3 pound not4-Dimethoxyphenyl)-N-methylethylamine, VERAPAMIL HYDROCHLORIDE IMPURITY B [EP IMPURITY], N-methyl-N-(2-(3,4-dimethoxy-phenyl)-ethyl)-amine, N-methyl-N-[2-(3,4-dimethoxy-phenyl)-ethyl]-amine, VERAPAMIL HYDROCHLORIDE IMPURITY B (EP IMPURITY), [2-(3,4-dimethoxy-phenyl)-ethyl]-methyl-amine, MFCD00067696, NSC187772, N-methyl-homoveratrylamine, [2-(3,4-Dimethoxyphenyl)Ethyl](Methyl)Amine, N-methyl-homoveratryl amine, MLS000516034, BIDD:GT0513, SCHEMBL557799, N-Methylhomoveratrylamine, 97%, CHEMBL1404381, DTXCID00110951, HMS2269O14, STL373398, AKOS000271141, 3,4-Dimethoxy-N-methylbenzenethanamine, 3,4-dimethoxyphenylethyl-N-methylamine, FD10469, 3,4-Dimethoxy-N-methylbenzeneethanamine, 3,4-dimethoxyphenylethyl-N-methyl-amine, N-methyl-3,4-dimethoxybenzeneethanamine, 2-(3,4-dimethoxyphenyl)ethylmethylamine, NCGC00247003-01, 2-(3,4-dimethoxyphenyl)ethylmethyl-amine, AS-48860, SMR000112502, N-(3,4-dimethoxyphenylethyl)-N-methylamine, D2104, N-(3,4-dimethoxy-phenylethyl)-N-methylamine, NS00003786, EN300-20597, N-Methyl-2-(3,4-dimethoxyphenyl)-ethylamine, N-(3,4-dimethoxy-phenylethyl)-N-methyl-amine, N-methyl-(2-(3,4-dimethoxyphenyl)ethyl)amine, AB00666237-06, N-(3,4-dimethoxy-phenyl ethyl)-N-methyl amine, N-[2-(3,4-dimethoxyphenyl)-ethyl]-N-methylamine, N-[2-(3,4-Dimethoxyphenyl)ethyl]-N-methylamine #, N-methyl-N-[2-(3,4-dimethoxyphenyl)-ethyl]-amine, N-methyl-N[2-(3,4-dimethoxy-phenyl)-ethyl]-amine, Q27262167, 222-483-9 |
|---|---|
| Topological Polar Surface Area | 30.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 14.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 152.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | Q962Y6, Q13315, P06746, Q92830, O89049, P39748, P63092 |
| Iupac Name | 2-(3,4-dimethoxyphenyl)-N-methylethanamine |
| Prediction Hob | 1.0 |
| Target Id | NPT524, NPT59 |
| Xlogp | 1.3 |
| Molecular Formula | C11H17NO2 |
| Prediction Swissadme | 1.0 |
| Inchi Key | HNJWKRMESUMDQE-UHFFFAOYSA-N |
| Fcsp3 | 0.4545454545454545 |
| Logs | -0.885 |
| Rotatable Bond Count | 5.0 |
| Logd | 1.18 |
| Compound Name | N-Methylhomoveratrylamine |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 195.126 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 195.126 |
| Hydrogen Bond Acceptor Count | 3.0 |
| Molecular Weight | 195.26 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -1.844167257142857 |
| Inchi | InChI=1S/C11H17NO2/c1-12-7-6-9-4-5-10(13-2)11(8-9)14-3/h4-5,8,12H,6-7H2,1-3H3 |
| Smiles | CNCCC1=CC(=C(C=C1)OC)OC |
| Nring | 1.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Delphinium Iliense (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all