2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol

C16H19NO2 — CID 107712248

IUPAC2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol
SMILESNCc1ccc(COc2ccccc2CCO)cc1
InChIInChI=1S/C16H19NO2/c17-11-13-5-7-14(8-6-13)12-19-16-4-2-1-3-15(16)9-10-18/h1-8,18H,9-12,17H2
InChIKeyDFAPYJAOYWMZTJ-UHFFFAOYSA-N
MW257.33 g/mol
LogP2.26
Rot. Bonds6

About 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol

2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol (PubChem CID 107712248) has the molecular formula C16H19NO2 and a molecular weight of 257.33 g/mol. Its IUPAC name is 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol.

Molecular Properties

Compound Name2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol
PubChem CID107712248
Molecular FormulaC16H19NO2
Molecular Weight257.33 g/mol
Exact Mass257.14
IUPAC Name2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol
SMILESNCc1ccc(COc2ccccc2CCO)cc1
InChIInChI=1S/C16H19NO2/c17-11-13-5-7-14(8-6-13)12-19-16-4-2-1-3-15(16)9-10-18/h1-8,18H,9-12,17H2
InChIKeyDFAPYJAOYWMZTJ-UHFFFAOYSA-N
XLogP2.26
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.33
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[4-(aminomethyl)phenyl]methoxy]phenol
CID 105486618
2-[2-[(4-amino-3-fluorophenyl)methoxy]phenyl]ethanol
CID 107712163
3-[[2-(2-hydroxyethyl)phenoxy]methyl]benzenecarbothioamide
CID 107712511
2-[2-[(4-octoxyphenyl)methoxy]phenyl]ethanol
CID 139712721
2-[2-(3-aminopropoxy)phenyl]ethanol
CID 107712249
2-[2-[(2,6-dimethylphenyl)methoxy]phenyl]ethanol
CID 107713072
2-(aminomethyl)-6-phenylmethoxyphenol
CID 117330545
3-[[2-(2-hydroxyethyl)phenoxy]methyl]benzenecarboximidamide
CID 107712654
2-[2-[(2-amino-6-bromophenyl)methoxy]phenyl]ethanol
CID 107712137
2-[2-[(6-hydrazinyl-2-pyridinyl)methoxy]phenyl]ethanol
CID 107714111
2-[2-[(4-amino-3-nitrophenyl)methoxy]phenyl]ethanol
CID 107714075
2-[2-[[4-(aminomethyl)-2-pyridinyl]oxy]phenyl]ethanol
CID 107711711

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol?
The IUPAC name of 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol (CID 107712248) is 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol.
What is the SMILES notation for 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol?
The canonical SMILES for 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol is NCc1ccc(COc2ccccc2CCO)cc1.
What is the InChIKey of 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol?
The InChIKey is DFAPYJAOYWMZTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2/c17-11-13-5-7-14(8-6-13)12-19-16-4-2-1-3-15(16)9-10-18/h1-8,18H,9-12,17H2.
What are the key properties of 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol?
2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol has a molecular weight of 257.33 g/mol, XLogP of 2.26, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[4-(aminomethyl)phenyl]methoxy]phenyl]ethanol is sourced from PubChem (CID 107712248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).