2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol

C17H20FNO2 — CID 110932160

IUPAC2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol
SMILESCOc1ccccc1CN(CCO)Cc1ccc(F)cc1
InChIInChI=1S/C17H20FNO2/c1-21-17-5-3-2-4-15(17)13-19(10-11-20)12-14-6-8-16(18)9-7-14/h2-9,20H,10-13H2,1H3
InChIKeyBSZCKOODBMBKCL-UHFFFAOYSA-N
MW289.35 g/mol
LogP2.83
Rot. Bonds7

About 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol

2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol (PubChem CID 110932160) has the molecular formula C17H20FNO2 and a molecular weight of 289.35 g/mol. Its IUPAC name is 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol
PubChem CID110932160
Molecular FormulaC17H20FNO2
Molecular Weight289.35 g/mol
Exact Mass289.15
IUPAC Name2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol
SMILESCOc1ccccc1CN(CCO)Cc1ccc(F)cc1
InChIInChI=1S/C17H20FNO2/c1-21-17-5-3-2-4-15(17)13-19(10-11-20)12-14-6-8-16(18)9-7-14/h2-9,20H,10-13H2,1H3
InChIKeyBSZCKOODBMBKCL-UHFFFAOYSA-N
XLogP2.83
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.35
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[benzyl-[(4-fluorophenyl)methyl]amino]ethanol
CID 14800643
2-[(2-methoxyphenyl)methyl-(2-phenylethyl)amino]ethanol
CID 110932203
2-[but-2-ynyl-[(2-methoxyphenyl)methyl]amino]ethanol
CID 111461930
2-[(2-methoxyphenyl)methyl-prop-2-enylamino]ethanol
CID 115610796
2-[(4-fluorophenyl)methyl-propylamino]ethanol
CID 783658
2-[benzyl-[(2-methoxyphenyl)methyl]amino]acetic acid
CID 39385257
[(2S)-3-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]-2-hydroxypropyl] butanoate
CID 93164283
2-[(3-amino-4-methoxyphenyl)methyl-benzylamino]ethanol
CID 62114410
1-[benzyl-[(2-methoxyphenyl)methyl]amino]propan-2-ol
CID 24714118
2-[(5-chloro-1-methylimidazol-2-yl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol
CID 110932185
2-[[2-(difluoromethoxy)phenyl]methyl-(2-hydroxyethyl)amino]ethanol
CID 62022488
2-[[5-(aminomethyl)-1,2,4-oxadiazol-3-yl]methyl-[(2-methoxyphenyl)methyl]amino]ethanol
CID 120751171

Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol?
The IUPAC name of 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol (CID 110932160) is 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol.
What is the SMILES notation for 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol?
The canonical SMILES for 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol is COc1ccccc1CN(CCO)Cc1ccc(F)cc1.
What is the InChIKey of 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol?
The InChIKey is BSZCKOODBMBKCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO2/c1-21-17-5-3-2-4-15(17)13-19(10-11-20)12-14-6-8-16(18)9-7-14/h2-9,20H,10-13H2,1H3.
What are the key properties of 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol?
2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol has a molecular weight of 289.35 g/mol, XLogP of 2.83, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenyl)methyl-[(2-methoxyphenyl)methyl]amino]ethanol is sourced from PubChem (CID 110932160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).