6-(2-methylphenoxy)pyridin-3-amine

C12H12N2O — CID 3031392

IUPAC6-(2-methylphenoxy)pyridin-3-amine
SMILESCc1ccccc1Oc1ccc(N)cn1
InChIInChI=1S/C12H12N2O/c1-9-4-2-3-5-11(9)15-12-7-6-10(13)8-14-12/h2-8H,13H2,1H3
InChIKeyFKZIVMODFXEOBP-UHFFFAOYSA-N
MW200.24 g/mol
LogP2.76
Rot. Bonds2

About 6-(2-methylphenoxy)pyridin-3-amine

6-(2-methylphenoxy)pyridin-3-amine (PubChem CID 3031392) has the molecular formula C12H12N2O and a molecular weight of 200.24 g/mol. Its IUPAC name is 6-(2-methylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(2-methylphenoxy)pyridin-3-amine
PubChem CID3031392
Molecular FormulaC12H12N2O
Molecular Weight200.24 g/mol
Exact Mass200.09
IUPAC Name6-(2-methylphenoxy)pyridin-3-amine
SMILESCc1ccccc1Oc1ccc(N)cn1
InChIInChI=1S/C12H12N2O/c1-9-4-2-3-5-11(9)15-12-7-6-10(13)8-14-12/h2-8H,13H2,1H3
InChIKeyFKZIVMODFXEOBP-UHFFFAOYSA-N
XLogP2.76
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.24
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(2-methylphenoxy)pyridin-3-amine?
The IUPAC name of 6-(2-methylphenoxy)pyridin-3-amine (CID 3031392) is 6-(2-methylphenoxy)pyridin-3-amine.
What is the SMILES notation for 6-(2-methylphenoxy)pyridin-3-amine?
The canonical SMILES for 6-(2-methylphenoxy)pyridin-3-amine is Cc1ccccc1Oc1ccc(N)cn1.
What is the InChIKey of 6-(2-methylphenoxy)pyridin-3-amine?
The InChIKey is FKZIVMODFXEOBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N2O/c1-9-4-2-3-5-11(9)15-12-7-6-10(13)8-14-12/h2-8H,13H2,1H3.
What are the key properties of 6-(2-methylphenoxy)pyridin-3-amine?
6-(2-methylphenoxy)pyridin-3-amine has a molecular weight of 200.24 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methylphenoxy)pyridin-3-amine is sourced from PubChem (CID 3031392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).