6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine

C15H18N6 — CID 82555417

IUPAC6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
SMILESCc1cc(N(C)CCc2ccncc2)cn2nc(N)nc12
InChIInChI=1S/C15H18N6/c1-11-9-13(10-21-14(11)18-15(16)19-21)20(2)8-5-12-3-6-17-7-4-12/h3-4,6-7,9-10H,5,8H2,1-2H3,(H2,16,19)
InChIKeyBGMQEUFLYJJIDB-UHFFFAOYSA-N
MW282.35 g/mol
LogP1.69
Rot. Bonds4

About 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine

6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine (PubChem CID 82555417) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine.

Molecular Properties

Compound Name6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
PubChem CID82555417
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine
SMILESCc1cc(N(C)CCc2ccncc2)cn2nc(N)nc12
InChIInChI=1S/C15H18N6/c1-11-9-13(10-21-14(11)18-15(16)19-21)20(2)8-5-12-3-6-17-7-4-12/h3-4,6-7,9-10H,5,8H2,1-2H3,(H2,16,19)
InChIKeyBGMQEUFLYJJIDB-UHFFFAOYSA-N
XLogP1.69
TPSA72.34 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The IUPAC name of 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine (CID 82555417) is 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine.
What is the SMILES notation for 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The canonical SMILES for 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine is Cc1cc(N(C)CCc2ccncc2)cn2nc(N)nc12.
What is the InChIKey of 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
The InChIKey is BGMQEUFLYJJIDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6/c1-11-9-13(10-21-14(11)18-15(16)19-21)20(2)8-5-12-3-6-17-7-4-12/h3-4,6-7,9-10H,5,8H2,1-2H3,(H2,16,19).
What are the key properties of 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine?
6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine has a molecular weight of 282.35 g/mol, XLogP of 1.69, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N,8-dimethyl-6-N-(2-pyridin-4-ylethyl)-[1,2,4]triazolo[1,5-a]pyridine-2,6-diamine is sourced from PubChem (CID 82555417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).