8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine

C10H12ClN5 — CID 139295630

IUPAC8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine
SMILESClc1nccn2c(N3CCCCC3)nnc12
InChIInChI=1S/C10H12ClN5/c11-8-9-13-14-10(16(9)7-4-12-8)15-5-2-1-3-6-15/h4,7H,1-3,5-6H2
InChIKeyLXZYXHGHBNGIBE-UHFFFAOYSA-N
MW237.69 g/mol
LogP1.77
Rot. Bonds1

About 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine

8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 139295630) has the molecular formula C10H12ClN5 and a molecular weight of 237.69 g/mol. Its IUPAC name is 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID139295630
Molecular FormulaC10H12ClN5
Molecular Weight237.69 g/mol
Exact Mass237.08
IUPAC Name8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine
SMILESClc1nccn2c(N3CCCCC3)nnc12
InChIInChI=1S/C10H12ClN5/c11-8-9-13-14-10(16(9)7-4-12-8)15-5-2-1-3-6-15/h4,7H,1-3,5-6H2
InChIKeyLXZYXHGHBNGIBE-UHFFFAOYSA-N
XLogP1.77
TPSA46.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine (CID 139295630) is 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine is Clc1nccn2c(N3CCCCC3)nnc12.
What is the InChIKey of 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is LXZYXHGHBNGIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClN5/c11-8-9-13-14-10(16(9)7-4-12-8)15-5-2-1-3-6-15/h4,7H,1-3,5-6H2.
What are the key properties of 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine?
8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 237.69 g/mol, XLogP of 1.77, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-3-piperidin-1-yl-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 139295630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).