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3-Methoxyamphetamine

PubChem CID: 152234

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Compound Synonyms 3-Methoxyamphetamine, 17862-85-0, 1-(3-methoxyphenyl)propan-2-amine, m-Methoxyamphetamine, Benzeneethanamine, 3-methoxy-alpha-methyl-, CHEMBL16247, C2B7C98LY8, 2-(3-Methoxyphenyl)-1-methylethylamine, meta-Methoxyamphetamine, 66033-00-9, 66033-04-3, 3-methoxyamphetamine -, 2-(3-Methoxy-phenyl)-1-methyl-ethylamine, 3-Methoxyphenylisopropylamine, NCIOpen2_006073, UNII-C2B7C98LY8, SCHEMBL269071, m-Methoxy-a-methylphenethylamine, DTXSID00939104, 3-Methoxy-a-methylbenzeneethanamine, 1-(3-methoxyphenyl)-2-propylamine, 1-(3-Methoxyphenyl)-2-propanamine, BDBM50024211, MFCD00869559, MFCD20449316, MFCD20458176, AKOS000157039, 1-(3-Methoxyphenyl)-2-propanamine #, AB76426, AB76439, MB01562, (R)-1-(3-Methoxyphenyl)-2-propanamine, (S)-1-(3-Methoxyphenyl)-2-propanamine, NCI60_042089, PD046544, SY384401, SY384402, SY384405, DB-225659, NS00018415, (+)-2-(3-methoxyphenyl)-1-methylethylamine, M-METHOXY-.ALPHA.-METHYLPHENETHYLAMINE, Benzeneethanamine, 3-methoxy-a-methyl- (9CI), 2-(3-Methoxy-phenyl)-1-methyl-ethylamine(MMA), (+/-)2-(3-Methoxy-phenyl)-1-methyl-ethylamine, Q4634160, (1R)-2-(3-METHOXYPHENYL)-1-METHYLETHYLAMINE, (1S)-2-(3-METHOXYPHENYL)-1-METHYLETHYLAMINE, BENZENEETHANAMINE, 3-METHOXY-.ALPHA.-METHYL-, Phenethylamine, m-methoxy-a-methyl- (6CI,7CI,8CI)
Topological Polar Surface Area 35.3
Hydrogen Bond Donor Count 1.0
Heavy Atom Count 12.0
Isotope Atom Count 0.0
Molecular Complexity 127.0
Database Name cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P28565, P14842, P08909, P30994
Iupac Name 1-(3-methoxyphenyl)propan-2-amine
Prediction Hob 1.0
Xlogp 2.0
Molecular Formula C10H15NO
Prediction Swissadme 1.0
Inchi Key VEJWNIYARKAHFI-UHFFFAOYSA-N
Fcsp3 0.4
Logs -2.568
Rotatable Bond Count 3.0
Logd 1.584
Compound Name 3-Methoxyamphetamine
Prediction Hob Swissadme 1.0
Exact Mass 165.115
Formal Charge 0.0
Monoisotopic Mass 165.115
Hydrogen Bond Acceptor Count 2.0
Molecular Weight 165.23
Covalent Unit Count 1.0
Total Atom Stereocenter Count 1.0
Total Bond Stereocenter Count 0.0
Esol -2.3279631999999997
Inchi InChI=1S/C10H15NO/c1-8(11)6-9-4-3-5-10(7-9)12-2/h3-5,7-8H,6,11H2,1-2H3
Smiles CC(CC1=CC(=CC=C1)OC)N
Nring 1.0
Defined Bond Stereocenter Count 0.0