6-(3,5-dimethoxyphenoxy)pyridin-3-amine

C13H14N2O3 — CID 43589800

IUPAC6-(3,5-dimethoxyphenoxy)pyridin-3-amine
SMILESCOc1cc(OC)cc(Oc2ccc(N)cn2)c1
InChIInChI=1S/C13H14N2O3/c1-16-10-5-11(17-2)7-12(6-10)18-13-4-3-9(14)8-15-13/h3-8H,14H2,1-2H3
InChIKeyZMQUEUDEUBTADO-UHFFFAOYSA-N
MW246.27 g/mol
LogP2.47
Rot. Bonds4

About 6-(3,5-dimethoxyphenoxy)pyridin-3-amine

6-(3,5-dimethoxyphenoxy)pyridin-3-amine (PubChem CID 43589800) has the molecular formula C13H14N2O3 and a molecular weight of 246.27 g/mol. Its IUPAC name is 6-(3,5-dimethoxyphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(3,5-dimethoxyphenoxy)pyridin-3-amine
PubChem CID43589800
Molecular FormulaC13H14N2O3
Molecular Weight246.27 g/mol
Exact Mass246.10
IUPAC Name6-(3,5-dimethoxyphenoxy)pyridin-3-amine
SMILESCOc1cc(OC)cc(Oc2ccc(N)cn2)c1
InChIInChI=1S/C13H14N2O3/c1-16-10-5-11(17-2)7-12(6-10)18-13-4-3-9(14)8-15-13/h3-8H,14H2,1-2H3
InChIKeyZMQUEUDEUBTADO-UHFFFAOYSA-N
XLogP2.47
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-(3,5-dimethoxyphenoxy)pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethoxyphenoxy)pyridin-3-amine?
The IUPAC name of 6-(3,5-dimethoxyphenoxy)pyridin-3-amine (CID 43589800) is 6-(3,5-dimethoxyphenoxy)pyridin-3-amine.
What is the SMILES notation for 6-(3,5-dimethoxyphenoxy)pyridin-3-amine?
The canonical SMILES for 6-(3,5-dimethoxyphenoxy)pyridin-3-amine is COc1cc(OC)cc(Oc2ccc(N)cn2)c1.
What is the InChIKey of 6-(3,5-dimethoxyphenoxy)pyridin-3-amine?
The InChIKey is ZMQUEUDEUBTADO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O3/c1-16-10-5-11(17-2)7-12(6-10)18-13-4-3-9(14)8-15-13/h3-8H,14H2,1-2H3.
What are the key properties of 6-(3,5-dimethoxyphenoxy)pyridin-3-amine?
6-(3,5-dimethoxyphenoxy)pyridin-3-amine has a molecular weight of 246.27 g/mol, XLogP of 2.47, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethoxyphenoxy)pyridin-3-amine is sourced from PubChem (CID 43589800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).