5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine

C12H13N3O — CID 79728874

IUPAC5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine
SMILESCOc1ccc(-c2cnc(N)cc2C)cn1
InChIInChI=1S/C12H13N3O/c1-8-5-11(13)14-7-10(8)9-3-4-12(16-2)15-6-9/h3-7H,1-2H3,(H2,13,14)
InChIKeyYYPSXNFTJIMTII-UHFFFAOYSA-N
MW215.26 g/mol
LogP2.04
Rot. Bonds2

About 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine

5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine (PubChem CID 79728874) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine.

Molecular Properties

Compound Name5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine
PubChem CID79728874
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine
SMILESCOc1ccc(-c2cnc(N)cc2C)cn1
InChIInChI=1S/C12H13N3O/c1-8-5-11(13)14-7-10(8)9-3-4-12(16-2)15-6-9/h3-7H,1-2H3,(H2,13,14)
InChIKeyYYPSXNFTJIMTII-UHFFFAOYSA-N
XLogP2.04
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-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 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine?
The IUPAC name of 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine (CID 79728874) is 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine.
What is the SMILES notation for 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine?
The canonical SMILES for 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine is COc1ccc(-c2cnc(N)cc2C)cn1.
What is the InChIKey of 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine?
The InChIKey is YYPSXNFTJIMTII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c1-8-5-11(13)14-7-10(8)9-3-4-12(16-2)15-6-9/h3-7H,1-2H3,(H2,13,14).
What are the key properties of 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine?
5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine has a molecular weight of 215.26 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methoxy-3-pyridinyl)-4-methylpyridin-2-amine is sourced from PubChem (CID 79728874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).