2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine

C13H15N3 — CID 80755629

IUPAC2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine
SMILESCNc1cccc(Nc2ccccc2C)n1
InChIInChI=1S/C13H15N3/c1-10-6-3-4-7-11(10)15-13-9-5-8-12(14-2)16-13/h3-9H,1-2H3,(H2,14,15,16)
InChIKeyQHVHSRAUPZKUOS-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.18
Rot. Bonds3

About 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine

2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine (PubChem CID 80755629) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine
PubChem CID80755629
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine
SMILESCNc1cccc(Nc2ccccc2C)n1
InChIInChI=1S/C13H15N3/c1-10-6-3-4-7-11(10)15-13-9-5-8-12(14-2)16-13/h3-9H,1-2H3,(H2,14,15,16)
InChIKeyQHVHSRAUPZKUOS-UHFFFAOYSA-N
XLogP3.18
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine?
The IUPAC name of 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine (CID 80755629) is 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine.
What is the SMILES notation for 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine?
The canonical SMILES for 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine is CNc1cccc(Nc2ccccc2C)n1.
What is the InChIKey of 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine?
The InChIKey is QHVHSRAUPZKUOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-10-6-3-4-7-11(10)15-13-9-5-8-12(14-2)16-13/h3-9H,1-2H3,(H2,14,15,16).
What are the key properties of 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine?
2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine has a molecular weight of 213.28 g/mol, XLogP of 3.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine is sourced from PubChem (CID 80755629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).