2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol

C17H21NO2 — CID 111118595

IUPAC2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol
SMILESCOc1ccccc1CNCC(O)c1ccccc1C
InChIInChI=1S/C17H21NO2/c1-13-7-3-5-9-15(13)16(19)12-18-11-14-8-4-6-10-17(14)20-2/h3-10,16,18-19H,11-12H2,1-2H3
InChIKeyLYYLJRGMZAZTRA-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.83
Rot. Bonds6

About 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol

2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol (PubChem CID 111118595) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol
PubChem CID111118595
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol
SMILESCOc1ccccc1CNCC(O)c1ccccc1C
InChIInChI=1S/C17H21NO2/c1-13-7-3-5-9-15(13)16(19)12-18-11-14-8-4-6-10-17(14)20-2/h3-10,16,18-19H,11-12H2,1-2H3
InChIKeyLYYLJRGMZAZTRA-UHFFFAOYSA-N
XLogP2.83
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4,5-dimethoxy-2-methylphenyl)methylamino]-1-(2-methylphenyl)ethanol
CID 111916640
1-(4-fluoro-3-methylphenyl)-2-[(2-methoxyphenyl)methylamino]ethanol
CID 82315000
1-(3,4-dimethoxyphenyl)-2-[(2-methylphenyl)methylamino]ethanol
CID 10851837
1-(3-fluorophenyl)-2-[(2-methoxyphenyl)methylamino]ethanol
CID 60896885
(2S)-1,1,1-trifluoro-3-[(2-methoxyphenyl)methylamino]propan-2-ol
CID 1482360
(2R)-1,1,1-trifluoro-3-[(2-methoxyphenyl)methylamino]propan-2-ol
CID 1482361
1-(3-bromophenyl)-2-[(2-methoxyphenyl)methylamino]ethanol
CID 23647926
(1S)-2-[(2-methoxyphenyl)methylamino]-1-[4-(trifluoromethyl)phenyl]ethanol
CID 46893460
2-amino-3-[(2-methoxyphenyl)methylamino]propan-1-ol
CID 115120623
(1R)-1-(2,5-dimethoxyphenyl)-2-[(2,5-dimethoxyphenyl)methylamino]ethanol
CID 94809006
(2R)-N-[(2-methoxyphenyl)methyl]-2-methylbutan-1-amine
CID 28612668
(1S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethylamino)-1-(2-methoxyphenyl)ethanol
CID 95579602

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol?
The IUPAC name of 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol (CID 111118595) is 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol.
What is the SMILES notation for 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol?
The canonical SMILES for 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol is COc1ccccc1CNCC(O)c1ccccc1C.
What is the InChIKey of 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol?
The InChIKey is LYYLJRGMZAZTRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-13-7-3-5-9-15(13)16(19)12-18-11-14-8-4-6-10-17(14)20-2/h3-10,16,18-19H,11-12H2,1-2H3.
What are the key properties of 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol?
2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol has a molecular weight of 271.36 g/mol, XLogP of 2.83, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methylamino]-1-(2-methylphenyl)ethanol is sourced from PubChem (CID 111118595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).