6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine

C13H15N3O — CID 75509865

IUPAC6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine
SMILESCc1cccc(NCCOc2cccnc2)n1
InChIInChI=1S/C13H15N3O/c1-11-4-2-6-13(16-11)15-8-9-17-12-5-3-7-14-10-12/h2-7,10H,8-9H2,1H3,(H,15,16)
InChIKeyZIRRBZMAJDGLEX-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.28
Rot. Bonds5

About 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine

6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine (PubChem CID 75509865) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine.

Molecular Properties

Compound Name6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine
PubChem CID75509865
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine
SMILESCc1cccc(NCCOc2cccnc2)n1
InChIInChI=1S/C13H15N3O/c1-11-4-2-6-13(16-11)15-8-9-17-12-5-3-7-14-10-12/h2-7,10H,8-9H2,1H3,(H,15,16)
InChIKeyZIRRBZMAJDGLEX-UHFFFAOYSA-N
XLogP2.28
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine?
The IUPAC name of 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine (CID 75509865) is 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine.
What is the SMILES notation for 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine?
The canonical SMILES for 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine is Cc1cccc(NCCOc2cccnc2)n1.
What is the InChIKey of 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine?
The InChIKey is ZIRRBZMAJDGLEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-11-4-2-6-13(16-11)15-8-9-17-12-5-3-7-14-10-12/h2-7,10H,8-9H2,1H3,(H,15,16).
What are the key properties of 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine?
6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine has a molecular weight of 229.28 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-pyridin-3-yloxyethyl)pyridin-2-amine is sourced from PubChem (CID 75509865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).