4-(4-amino-3-methylphenoxy)phenol

C13H13NO2 — CID 150102226

IUPAC4-(4-amino-3-methylphenoxy)phenol
SMILESCc1cc(Oc2ccc(O)cc2)ccc1N
InChIInChI=1S/C13H13NO2/c1-9-8-12(6-7-13(9)14)16-11-4-2-10(15)3-5-11/h2-8,15H,14H2,1H3
InChIKeyDVMMVHDZQIFZCR-UHFFFAOYSA-N
MW215.25 g/mol
LogP3.08
Rot. Bonds2

About 4-(4-amino-3-methylphenoxy)phenol

4-(4-amino-3-methylphenoxy)phenol (PubChem CID 150102226) has the molecular formula C13H13NO2 and a molecular weight of 215.25 g/mol. Its IUPAC name is 4-(4-amino-3-methylphenoxy)phenol.

Molecular Properties

Compound Name4-(4-amino-3-methylphenoxy)phenol
PubChem CID150102226
Molecular FormulaC13H13NO2
Molecular Weight215.25 g/mol
Exact Mass215.09
IUPAC Name4-(4-amino-3-methylphenoxy)phenol
SMILESCc1cc(Oc2ccc(O)cc2)ccc1N
InChIInChI=1S/C13H13NO2/c1-9-8-12(6-7-13(9)14)16-11-4-2-10(15)3-5-11/h2-8,15H,14H2,1H3
InChIKeyDVMMVHDZQIFZCR-UHFFFAOYSA-N
XLogP3.08
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.25
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-(4-amino-3-methylphenoxy)benzamide
CID 43381706
4-[7-(4-amino-3-methylphenoxy)naphthalen-2-yl]oxy-2-methylaniline
CID 139654231
4-(4-ethylphenoxy)-2-methylaniline
CID 26190351
4-(6-bromonaphthalen-2-yl)oxy-2-methylaniline
CID 43436384
4-aminophenol;2-methylbenzene-1,4-diamine
CID 160894868
4-(4-amino-3-methylphenoxy)-2-methylbenzonitrile
CID 81279568
methyl 2-amino-5-(3,4-dimethylphenoxy)benzoate
CID 63423501
bis(4-(4-hydroxyphenoxy)phenol);hydrate
CID 67711282
2-methyl-4-pyridin-3-yloxyaniline;hydrochloride
CID 156593409
2-amino-5-(4-bromo-3-methylphenoxy)benzoic acid
CID 83134573
4-amino-3-methylphenol;4-(methylamino)phenol
CID 69014448
(4-amino-3-methylphenyl) 2,2-dimethylpropanoate
CID 19810868

Frequently Asked Questions

What is the IUPAC name of 4-(4-amino-3-methylphenoxy)phenol?
The IUPAC name of 4-(4-amino-3-methylphenoxy)phenol (CID 150102226) is 4-(4-amino-3-methylphenoxy)phenol.
What is the SMILES notation for 4-(4-amino-3-methylphenoxy)phenol?
The canonical SMILES for 4-(4-amino-3-methylphenoxy)phenol is Cc1cc(Oc2ccc(O)cc2)ccc1N.
What is the InChIKey of 4-(4-amino-3-methylphenoxy)phenol?
The InChIKey is DVMMVHDZQIFZCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2/c1-9-8-12(6-7-13(9)14)16-11-4-2-10(15)3-5-11/h2-8,15H,14H2,1H3.
What are the key properties of 4-(4-amino-3-methylphenoxy)phenol?
4-(4-amino-3-methylphenoxy)phenol has a molecular weight of 215.25 g/mol, XLogP of 3.08, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-amino-3-methylphenoxy)phenol is sourced from PubChem (CID 150102226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).