6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine

C20H24N6 — CID 52911916

IUPAC6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine
SMILESCNc1cccc(CCNc2cccc(NCCc3ccccn3)n2)n1
InChIInChI=1S/C20H24N6/c1-21-18-8-4-7-17(25-18)12-15-24-20-10-5-9-19(26-20)23-14-11-16-6-2-3-13-22-16/h2-10,13H,11-12,14-15H2,1H3,(H,21,25)(H2,23,24,26)
InChIKeyUBTKZTATSDDFNI-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.22
Rot. Bonds9

About 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine

6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine (PubChem CID 52911916) has the molecular formula C20H24N6 and a molecular weight of 348.45 g/mol. Its IUPAC name is 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine
PubChem CID52911916
Molecular FormulaC20H24N6
Molecular Weight348.45 g/mol
Exact Mass348.21
IUPAC Name6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine
SMILESCNc1cccc(CCNc2cccc(NCCc3ccccn3)n2)n1
InChIInChI=1S/C20H24N6/c1-21-18-8-4-7-17(25-18)12-15-24-20-10-5-9-19(26-20)23-14-11-16-6-2-3-13-22-16/h2-10,13H,11-12,14-15H2,1H3,(H,21,25)(H2,23,24,26)
InChIKeyUBTKZTATSDDFNI-UHFFFAOYSA-N
XLogP3.22
TPSA74.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 53.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine 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-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine?
The IUPAC name of 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine (CID 52911916) is 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine.
What is the SMILES notation for 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine?
The canonical SMILES for 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine is CNc1cccc(CCNc2cccc(NCCc3ccccn3)n2)n1.
What is the InChIKey of 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine?
The InChIKey is UBTKZTATSDDFNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6/c1-21-18-8-4-7-17(25-18)12-15-24-20-10-5-9-19(26-20)23-14-11-16-6-2-3-13-22-16/h2-10,13H,11-12,14-15H2,1H3,(H,21,25)(H2,23,24,26).
What are the key properties of 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine?
6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine has a molecular weight of 348.45 g/mol, XLogP of 3.22, 9 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[2-[6-(methylamino)-2-pyridinyl]ethyl]-2-N-(2-pyridin-2-ylethyl)pyridine-2,6-diamine is sourced from PubChem (CID 52911916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).