3-[(6-amino-2-pyridinyl)methoxy]phenol

C12H12N2O2 — CID 105469629

IUPAC3-[(6-amino-2-pyridinyl)methoxy]phenol
SMILESNc1cccc(COc2cccc(O)c2)n1
InChIInChI=1S/C12H12N2O2/c13-12-6-1-3-9(14-12)8-16-11-5-2-4-10(15)7-11/h1-7,15H,8H2,(H2,13,14)
InChIKeyVQCCUOHRKNMLDS-UHFFFAOYSA-N
MW216.24 g/mol
LogP1.95
Rot. Bonds3

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

3-[(6-amino-2-pyridinyl)methoxy]phenol (PubChem CID 105469629) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 3-[(6-amino-2-pyridinyl)methoxy]phenol.

Molecular Properties

Compound Name3-[(6-amino-2-pyridinyl)methoxy]phenol
PubChem CID105469629
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name3-[(6-amino-2-pyridinyl)methoxy]phenol
SMILESNc1cccc(COc2cccc(O)c2)n1
InChIInChI=1S/C12H12N2O2/c13-12-6-1-3-9(14-12)8-16-11-5-2-4-10(15)7-11/h1-7,15H,8H2,(H2,13,14)
InChIKeyVQCCUOHRKNMLDS-UHFFFAOYSA-N
XLogP1.95
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(6-amino-2-pyridinyl)methoxy]phenol?
The IUPAC name of 3-[(6-amino-2-pyridinyl)methoxy]phenol (CID 105469629) is 3-[(6-amino-2-pyridinyl)methoxy]phenol.
What is the SMILES notation for 3-[(6-amino-2-pyridinyl)methoxy]phenol?
The canonical SMILES for 3-[(6-amino-2-pyridinyl)methoxy]phenol is Nc1cccc(COc2cccc(O)c2)n1.
What is the InChIKey of 3-[(6-amino-2-pyridinyl)methoxy]phenol?
The InChIKey is VQCCUOHRKNMLDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c13-12-6-1-3-9(14-12)8-16-11-5-2-4-10(15)7-11/h1-7,15H,8H2,(H2,13,14).
What are the key properties of 3-[(6-amino-2-pyridinyl)methoxy]phenol?
3-[(6-amino-2-pyridinyl)methoxy]phenol has a molecular weight of 216.24 g/mol, XLogP of 1.95, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-amino-2-pyridinyl)methoxy]phenol is sourced from PubChem (CID 105469629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).