2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol

C15H17NO3 — CID 117244585

IUPAC2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol
SMILESCOc1ccc(C(N)COc2ccccc2O)cc1
InChIInChI=1S/C15H17NO3/c1-18-12-8-6-11(7-9-12)13(16)10-19-15-5-3-2-4-14(15)17/h2-9,13,17H,10,16H2,1H3
InChIKeyOCUGXMDIQBOGJE-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.48
Rot. Bonds5

About 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol

2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol (PubChem CID 117244585) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol.

Molecular Properties

Compound Name2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol
PubChem CID117244585
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Name2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol
SMILESCOc1ccc(C(N)COc2ccccc2O)cc1
InChIInChI=1S/C15H17NO3/c1-18-12-8-6-11(7-9-12)13(16)10-19-15-5-3-2-4-14(15)17/h2-9,13,17H,10,16H2,1H3
InChIKeyOCUGXMDIQBOGJE-UHFFFAOYSA-N
XLogP2.48
TPSA64.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-amino-2-(4-methoxyphenyl)propoxy]phenol
CID 117244895
2-(2-methoxyphenoxy)-1-(4-methylphenyl)ethanamine
CID 16783711
2-(3,5-dimethylphenoxy)-1-(4-methoxyphenyl)ethanamine
CID 16793482
1-(3-methoxyphenyl)-2-naphthalen-1-yloxyethanamine
CID 16788018
2-(3,4-dimethylphenoxy)-1-(4-methoxyphenyl)ethanamine
CID 16784581
2-(2-methoxyphenoxy)-1-[4-(trifluoromethyl)phenyl]ethanamine
CID 117244544
2-(4-methoxyphenoxy)phenol
CID 54145402
2-[3-(methoxymethyl)phenoxy]-1-(4-methoxyphenyl)ethanamine
CID 63986560
1,5-bis(2-methoxyphenoxy)-2,4-bis(4-methoxyphenyl)pentan-3-one
CID 150588939
2-(2-chlorophenoxy)-1-(4-methoxyphenyl)ethanol
CID 117244582
2-(4-methoxy-2-nitrophenoxy)-1-phenylethanamine
CID 63773458
(1S)-2-(2-methylphenoxy)-1-phenylethanamine;hydrochloride
CID 164614673

Frequently Asked Questions

What is the IUPAC name of 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol?
The IUPAC name of 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol (CID 117244585) is 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol.
What is the SMILES notation for 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol?
The canonical SMILES for 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol is COc1ccc(C(N)COc2ccccc2O)cc1.
What is the InChIKey of 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol?
The InChIKey is OCUGXMDIQBOGJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-18-12-8-6-11(7-9-12)13(16)10-19-15-5-3-2-4-14(15)17/h2-9,13,17H,10,16H2,1H3.
What are the key properties of 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol?
2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol has a molecular weight of 259.31 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-amino-2-(4-methoxyphenyl)ethoxy]phenol is sourced from PubChem (CID 117244585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).