6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine

C12H17N5 — CID 67528754

IUPAC6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine
SMILESNc1nc2ccc(C3CCCCC3)c(N)n2n1
InChIInChI=1S/C12H17N5/c13-11-9(8-4-2-1-3-5-8)6-7-10-15-12(14)16-17(10)11/h6-8H,1-5,13H2,(H2,14,16)
InChIKeyRJSYJDZRWZWHAN-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.94
Rot. Bonds1

About 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine

6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine (PubChem CID 67528754) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine.

Molecular Properties

Compound Name6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine
PubChem CID67528754
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine
SMILESNc1nc2ccc(C3CCCCC3)c(N)n2n1
InChIInChI=1S/C12H17N5/c13-11-9(8-4-2-1-3-5-8)6-7-10-15-12(14)16-17(10)11/h6-8H,1-5,13H2,(H2,14,16)
InChIKeyRJSYJDZRWZWHAN-UHFFFAOYSA-N
XLogP1.94
TPSA82.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine?
The IUPAC name of 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine (CID 67528754) is 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine.
What is the SMILES notation for 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine?
The canonical SMILES for 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine is Nc1nc2ccc(C3CCCCC3)c(N)n2n1.
What is the InChIKey of 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine?
The InChIKey is RJSYJDZRWZWHAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c13-11-9(8-4-2-1-3-5-8)6-7-10-15-12(14)16-17(10)11/h6-8H,1-5,13H2,(H2,14,16).
What are the key properties of 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine?
6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine has a molecular weight of 231.30 g/mol, XLogP of 1.94, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-[1,2,4]triazolo[1,5-a]pyridine-2,5-diamine is sourced from PubChem (CID 67528754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).