2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol

C12H12N2O2 — CID 114764591

IUPAC2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol
SMILESCc1cccc(Oc2cccc(O)c2N)n1
InChIInChI=1S/C12H12N2O2/c1-8-4-2-7-11(14-8)16-10-6-3-5-9(15)12(10)13/h2-7,15H,13H2,1H3
InChIKeyHOLSEMZGTPIUMY-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.47
Rot. Bonds2

About 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol

2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol (PubChem CID 114764591) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol.

Molecular Properties

Compound Name2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol
PubChem CID114764591
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol
SMILESCc1cccc(Oc2cccc(O)c2N)n1
InChIInChI=1S/C12H12N2O2/c1-8-4-2-7-11(14-8)16-10-6-3-5-9(15)12(10)13/h2-7,15H,13H2,1H3
InChIKeyHOLSEMZGTPIUMY-UHFFFAOYSA-N
XLogP2.47
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-amino-3-hydroxyphenoxy)-6-methylpyridine-3-carbonitrile
CID 114764695
4-chloro-2-[(6-methyl-2-pyridinyl)oxy]aniline
CID 62306214
ethyl 6-(2-amino-3-hydroxyphenoxy)pyridine-3-carboxylate
CID 114764586
5-(2-amino-3-hydroxyphenoxy)pyrazine-2-carbonitrile
CID 137013341
2-amino-3-aminooxyphenol;dihydrochloride
CID 19876209
2-chloro-4-[(6-methyl-2-pyridinyl)oxy]aniline
CID 62113791
5-amino-4-(2-amino-3-hydroxyphenoxy)-1H-pyrimidin-6-one
CID 114764582
2-methyl-3-(6-methylpyrimidin-4-yl)oxyphenol
CID 61224160
2-methyl-6-(4-methylsulfanylphenoxy)pyridine
CID 123742413
2-(4-chlorophenoxy)-6-methylpyridine;ethane
CID 168898019
[3,5-dimethyl-4-[(6-methyl-2-pyridinyl)oxy]phenyl]methanamine
CID 65471008
2-(2-amino-3-hydroxyphenoxy)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
CID 114764610

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol?
The IUPAC name of 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol (CID 114764591) is 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol.
What is the SMILES notation for 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol?
The canonical SMILES for 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol is Cc1cccc(Oc2cccc(O)c2N)n1.
What is the InChIKey of 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol?
The InChIKey is HOLSEMZGTPIUMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-8-4-2-7-11(14-8)16-10-6-3-5-9(15)12(10)13/h2-7,15H,13H2,1H3.
What are the key properties of 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol?
2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol has a molecular weight of 216.24 g/mol, XLogP of 2.47, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-[(6-methyl-2-pyridinyl)oxy]phenol is sourced from PubChem (CID 114764591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).