2-amino-4-(4-phenylphenoxy)phenol

C18H15NO2 — CID 141458116

IUPAC2-amino-4-(4-phenylphenoxy)phenol
SMILESNc1cc(Oc2ccc(-c3ccccc3)cc2)ccc1O
InChIInChI=1S/C18H15NO2/c19-17-12-16(10-11-18(17)20)21-15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12,20H,19H2
InChIKeyHJLDNSJLCUYXPR-UHFFFAOYSA-N
MW277.32 g/mol
LogP4.43
Rot. Bonds3

About 2-amino-4-(4-phenylphenoxy)phenol

2-amino-4-(4-phenylphenoxy)phenol (PubChem CID 141458116) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is 2-amino-4-(4-phenylphenoxy)phenol.

Molecular Properties

Compound Name2-amino-4-(4-phenylphenoxy)phenol
PubChem CID141458116
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name2-amino-4-(4-phenylphenoxy)phenol
SMILESNc1cc(Oc2ccc(-c3ccccc3)cc2)ccc1O
InChIInChI=1S/C18H15NO2/c19-17-12-16(10-11-18(17)20)21-15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12,20H,19H2
InChIKeyHJLDNSJLCUYXPR-UHFFFAOYSA-N
XLogP4.43
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 54.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

2-amino-4-[2-(3-amino-4-hydroxyphenoxy)-3-phenylphenoxy]phenol
CID 129308077
2-amino-4-[6-(3-amino-4-hydroxyphenoxy)-4,8-bis(2-phenylethynyl)naphthalen-2-yl]oxyphenol
CID 139999304
4-(3-amino-4-hydroxyphenoxy)benzaldehyde;ethane
CID 91598019
lithium;hydride;1-phenyl-4-(4-phenylphenoxy)benzene
CID 175041898
1-phenoxy-4-(3-phenylphenoxy)benzene
CID 14832823
4-(4-amino-3-phenylphenoxy)-2-phenylaniline
CID 69279475
CID 174308979
CID 174308979
2-iodo-4-phenoxyphenol
CID 10710201
2-methyl-4-phenoxyphenol
CID 23089676
2-amino-4-[5-(3-amino-4-hydroxyphenoxy)-3,4,7,8-tetrakis(2-phenylethynyl)naphthalen-1-yl]oxyphenol
CID 139999397
2-amino-5-[4-[10-[4-(4-methylphenoxy)phenyl]anthracen-9-yl]phenoxy]phenol
CID 22979018
2-amino-4-[6-(3-amino-4-hydroxyphenoxy)-5,7-bis(2-phenylethynyl)naphthalen-2-yl]oxyphenol
CID 139999402

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(4-phenylphenoxy)phenol?
The IUPAC name of 2-amino-4-(4-phenylphenoxy)phenol (CID 141458116) is 2-amino-4-(4-phenylphenoxy)phenol.
What is the SMILES notation for 2-amino-4-(4-phenylphenoxy)phenol?
The canonical SMILES for 2-amino-4-(4-phenylphenoxy)phenol is Nc1cc(Oc2ccc(-c3ccccc3)cc2)ccc1O.
What is the InChIKey of 2-amino-4-(4-phenylphenoxy)phenol?
The InChIKey is HJLDNSJLCUYXPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c19-17-12-16(10-11-18(17)20)21-15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12,20H,19H2.
What are the key properties of 2-amino-4-(4-phenylphenoxy)phenol?
2-amino-4-(4-phenylphenoxy)phenol has a molecular weight of 277.32 g/mol, XLogP of 4.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(4-phenylphenoxy)phenol is sourced from PubChem (CID 141458116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).