2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine

C20H24N6 — CID 52911915

IUPAC2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine
SMILESCNc1cccc(NCCc2cccc(NCCc3ccccn3)n2)n1
InChIInChI=1S/C20H24N6/c1-21-18-8-5-10-20(26-18)24-15-12-17-7-4-9-19(25-17)23-14-11-16-6-2-3-13-22-16/h2-10,13H,11-12,14-15H2,1H3,(H,23,25)(H2,21,24,26)
InChIKeyMYVYZANVXKFLRU-UHFFFAOYSA-N
MW348.45 g/mol
LogP3.22
Rot. Bonds9

About 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine

2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine (PubChem CID 52911915) has the molecular formula C20H24N6 and a molecular weight of 348.45 g/mol. Its IUPAC name is 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine.

Molecular Properties

Compound Name2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine
PubChem CID52911915
Molecular FormulaC20H24N6
Molecular Weight348.45 g/mol
Exact Mass348.21
IUPAC Name2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine
SMILESCNc1cccc(NCCc2cccc(NCCc3ccccn3)n2)n1
InChIInChI=1S/C20H24N6/c1-21-18-8-5-10-20(26-18)24-15-12-17-7-4-9-19(25-17)23-14-11-16-6-2-3-13-22-16/h2-10,13H,11-12,14-15H2,1H3,(H,23,25)(H2,21,24,26)
InChIKeyMYVYZANVXKFLRU-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

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Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine?
The IUPAC name of 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine (CID 52911915) is 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine.
What is the SMILES notation for 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine?
The canonical SMILES for 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine is CNc1cccc(NCCc2cccc(NCCc3ccccn3)n2)n1.
What is the InChIKey of 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine?
The InChIKey is MYVYZANVXKFLRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N6/c1-21-18-8-5-10-20(26-18)24-15-12-17-7-4-9-19(25-17)23-14-11-16-6-2-3-13-22-16/h2-10,13H,11-12,14-15H2,1H3,(H,23,25)(H2,21,24,26).
What are the key properties of 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine?
2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]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 2-N-methyl-6-N-[2-[6-(2-pyridin-2-ylethylamino)-2-pyridinyl]ethyl]pyridine-2,6-diamine is sourced from PubChem (CID 52911915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).