N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine

C10H11ClN6 — CID 133281563

IUPACN-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
SMILESClc1cncc(NC2CCc3ncnn3C2)n1
InChIInChI=1S/C10H11ClN6/c11-8-3-12-4-9(16-8)15-7-1-2-10-13-6-14-17(10)5-7/h3-4,6-7H,1-2,5H2,(H,15,16)
InChIKeyMZGHUFLBVFSOOL-UHFFFAOYSA-N
MW250.69 g/mol
LogP1.15
Rot. Bonds2

About N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine

N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (PubChem CID 133281563) has the molecular formula C10H11ClN6 and a molecular weight of 250.69 g/mol. Its IUPAC name is N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound NameN-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
PubChem CID133281563
Molecular FormulaC10H11ClN6
Molecular Weight250.69 g/mol
Exact Mass250.07
IUPAC NameN-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
SMILESClc1cncc(NC2CCc3ncnn3C2)n1
InChIInChI=1S/C10H11ClN6/c11-8-3-12-4-9(16-8)15-7-1-2-10-13-6-14-17(10)5-7/h3-4,6-7H,1-2,5H2,(H,15,16)
InChIKeyMZGHUFLBVFSOOL-UHFFFAOYSA-N
XLogP1.15
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.69
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The IUPAC name of N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (CID 133281563) is N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine.
What is the SMILES notation for N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The canonical SMILES for N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine is Clc1cncc(NC2CCc3ncnn3C2)n1.
What is the InChIKey of N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The InChIKey is MZGHUFLBVFSOOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN6/c11-8-3-12-4-9(16-8)15-7-1-2-10-13-6-14-17(10)5-7/h3-4,6-7H,1-2,5H2,(H,15,16).
What are the key properties of N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine has a molecular weight of 250.69 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 133281563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).