2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol

C17H21NO2 — CID 82312256

IUPAC2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol
SMILESCOc1ccc(CNCC(O)c2ccc(C)cc2)cc1
InChIInChI=1S/C17H21NO2/c1-13-3-7-15(8-4-13)17(19)12-18-11-14-5-9-16(20-2)10-6-14/h3-10,17-19H,11-12H2,1-2H3
InChIKeyFAFBWSLAAYPVCO-UHFFFAOYSA-N
MW271.36 g/mol
LogP2.83
Rot. Bonds6

About 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol

2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol (PubChem CID 82312256) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol.

Molecular Properties

Compound Name2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol
PubChem CID82312256
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol
SMILESCOc1ccc(CNCC(O)c2ccc(C)cc2)cc1
InChIInChI=1S/C17H21NO2/c1-13-3-7-15(8-4-13)17(19)12-18-11-14-5-9-16(20-2)10-6-14/h3-10,17-19H,11-12H2,1-2H3
InChIKeyFAFBWSLAAYPVCO-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

1-(4-methoxyphenyl)-2-[[(1R)-1-(4-methylphenyl)ethyl]amino]ethanol
CID 81347393
1-[(4-methoxyphenyl)methylamino]butan-2-ol
CID 23060649
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-4-methylbenzamide
CID 110889479
1-(4-methoxyphenyl)-2-(prop-2-ynylamino)ethanol
CID 60903384
2-(4-ethylanilino)-1-(4-methoxyphenyl)ethanol
CID 60901649
N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-4-methylbenzenesulfonamide
CID 12032646
2-[(6-chloro-3-pyridinyl)methylamino]-1-(4-methylphenyl)ethanol
CID 111476645
N-[(4-methoxyphenyl)methyl]-2-(4-methylphenyl)ethanamine
CID 16753278
1,1-difluoro-3-[[2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]propan-2-ol
CID 114093465
1-[4-[2-hydroxy-3-[(4-methylphenyl)methylamino]propoxy]phenoxy]-3-[(4-methylphenyl)methylamino]propan-2-ol
CID 19133404
N-[(4-methoxyphenyl)methyl]-1-(4-propan-2-ylphenyl)methanamine
CID 796206
2-hydrazinyl-1-(4-methoxyphenyl)ethanol
CID 21361112

Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol?
The IUPAC name of 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol (CID 82312256) is 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol.
What is the SMILES notation for 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol?
The canonical SMILES for 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol is COc1ccc(CNCC(O)c2ccc(C)cc2)cc1.
What is the InChIKey of 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol?
The InChIKey is FAFBWSLAAYPVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-13-3-7-15(8-4-13)17(19)12-18-11-14-5-9-16(20-2)10-6-14/h3-10,17-19H,11-12H2,1-2H3.
What are the key properties of 2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol?
2-[(4-methoxyphenyl)methylamino]-1-(4-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-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)ethanol is sourced from PubChem (CID 82312256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).