6-(3-methoxyphenoxy)pyridin-3-amine

C12H12N2O2 — CID 806744

IUPAC6-(3-methoxyphenoxy)pyridin-3-amine
SMILESCOc1cccc(Oc2ccc(N)cn2)c1
InChIInChI=1S/C12H12N2O2/c1-15-10-3-2-4-11(7-10)16-12-6-5-9(13)8-14-12/h2-8H,13H2,1H3
InChIKeyMZXBOWPVJDFSKP-UHFFFAOYSA-N
MW216.24 g/mol
LogP2.46
Rot. Bonds3

About 6-(3-methoxyphenoxy)pyridin-3-amine

6-(3-methoxyphenoxy)pyridin-3-amine (PubChem CID 806744) has the molecular formula C12H12N2O2 and a molecular weight of 216.24 g/mol. Its IUPAC name is 6-(3-methoxyphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(3-methoxyphenoxy)pyridin-3-amine
PubChem CID806744
Molecular FormulaC12H12N2O2
Molecular Weight216.24 g/mol
Exact Mass216.09
IUPAC Name6-(3-methoxyphenoxy)pyridin-3-amine
SMILESCOc1cccc(Oc2ccc(N)cn2)c1
InChIInChI=1S/C12H12N2O2/c1-15-10-3-2-4-11(7-10)16-12-6-5-9(13)8-14-12/h2-8H,13H2,1H3
InChIKeyMZXBOWPVJDFSKP-UHFFFAOYSA-N
XLogP2.46
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_A(8)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(3-methoxyphenoxy)pyridin-3-amine?
The IUPAC name of 6-(3-methoxyphenoxy)pyridin-3-amine (CID 806744) is 6-(3-methoxyphenoxy)pyridin-3-amine.
What is the SMILES notation for 6-(3-methoxyphenoxy)pyridin-3-amine?
The canonical SMILES for 6-(3-methoxyphenoxy)pyridin-3-amine is COc1cccc(Oc2ccc(N)cn2)c1.
What is the InChIKey of 6-(3-methoxyphenoxy)pyridin-3-amine?
The InChIKey is MZXBOWPVJDFSKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O2/c1-15-10-3-2-4-11(7-10)16-12-6-5-9(13)8-14-12/h2-8H,13H2,1H3.
What are the key properties of 6-(3-methoxyphenoxy)pyridin-3-amine?
6-(3-methoxyphenoxy)pyridin-3-amine has a molecular weight of 216.24 g/mol, XLogP of 2.46, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methoxyphenoxy)pyridin-3-amine is sourced from PubChem (CID 806744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).