2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine

C13H11N7 — CID 170562506

IUPAC2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine
SMILESNc1c(-c2ccnnn2)cnc(-c2ccccn2)c1N
InChIInChI=1S/C13H11N7/c14-11-8(9-4-6-18-20-19-9)7-17-13(12(11)15)10-3-1-2-5-16-10/h1-7H,15H2,(H2,14,17)
InChIKeyWJGMLOOPFZRZDU-UHFFFAOYSA-N
MW265.28 g/mol
LogP1.16
Rot. Bonds2

About 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine

2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine (PubChem CID 170562506) has the molecular formula C13H11N7 and a molecular weight of 265.28 g/mol. Its IUPAC name is 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine.

Molecular Properties

Compound Name2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine
PubChem CID170562506
Molecular FormulaC13H11N7
Molecular Weight265.28 g/mol
Exact Mass265.11
IUPAC Name2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine
SMILESNc1c(-c2ccnnn2)cnc(-c2ccccn2)c1N
InChIInChI=1S/C13H11N7/c14-11-8(9-4-6-18-20-19-9)7-17-13(12(11)15)10-3-1-2-5-16-10/h1-7H,15H2,(H2,14,17)
InChIKeyWJGMLOOPFZRZDU-UHFFFAOYSA-N
XLogP1.16
TPSA116.49 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.28
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2,3,4,5-tetrapyridin-2-ylpyridine
CID 22045955
methane;2-pyridin-2-ylpyridine-3,4-diamine
CID 145033572
europium;bis(2-pyridin-2-ylpyridine);2-pyridin-2-ylpyridine-3,4-diamine
CID 173288202
1,4-dipyridin-2-yl-5,6,7,8-tetrahydrophthalazine
CID 15911741
5,8,13,16-tetrapyridin-2-yl-6,7,14,15-tetrazatricyclo[10.4.0.04,9]hexadeca-1(12),4(9),5,7,13,15-hexaene
CID 101424910
4-(3-phenyl-2-pyridinyl)triazine
CID 171060242
pyrrolo[3,2-b]azepine
CID 66934182
5-(2-pyridin-2-yl-3-pyridinyl)pyrimidine-2,4-diamine
CID 175838941
4-pyrazin-2-yltriazine
CID 69484540
4-pyridin-2-yl-5-pyrimidin-2-ylpyridazine
CID 54320064
4-(2-chlorophenyl)triazine
CID 22902708
5-pyridin-2-yl-1,2,4-triazin-3-amine
CID 43134555

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine?
The IUPAC name of 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine (CID 170562506) is 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine.
What is the SMILES notation for 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine?
The canonical SMILES for 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine is Nc1c(-c2ccnnn2)cnc(-c2ccccn2)c1N.
What is the InChIKey of 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine?
The InChIKey is WJGMLOOPFZRZDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N7/c14-11-8(9-4-6-18-20-19-9)7-17-13(12(11)15)10-3-1-2-5-16-10/h1-7H,15H2,(H2,14,17).
What are the key properties of 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine?
2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine has a molecular weight of 265.28 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-5-(triazin-4-yl)pyridine-3,4-diamine is sourced from PubChem (CID 170562506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).