3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine

C13H11N5 — CID 43479044

IUPAC3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine
SMILESc1ccc2c(c1)CC(c1nnc3cnccn13)N2
InChIInChI=1S/C13H11N5/c1-2-4-10-9(3-1)7-11(15-10)13-17-16-12-8-14-5-6-18(12)13/h1-6,8,11,15H,7H2
InChIKeyMOGKENBQHYCIBB-UHFFFAOYSA-N
MW237.27 g/mol
LogP1.83
Rot. Bonds1

About 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine

3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 43479044) has the molecular formula C13H11N5 and a molecular weight of 237.27 g/mol. Its IUPAC name is 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID43479044
Molecular FormulaC13H11N5
Molecular Weight237.27 g/mol
Exact Mass237.10
IUPAC Name3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine
SMILESc1ccc2c(c1)CC(c1nnc3cnccn13)N2
InChIInChI=1S/C13H11N5/c1-2-4-10-9(3-1)7-11(15-10)13-17-16-12-8-14-5-6-18(12)13/h1-6,8,11,15H,7H2
InChIKeyMOGKENBQHYCIBB-UHFFFAOYSA-N
XLogP1.83
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine (CID 43479044) is 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine is c1ccc2c(c1)CC(c1nnc3cnccn13)N2.
What is the InChIKey of 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is MOGKENBQHYCIBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5/c1-2-4-10-9(3-1)7-11(15-10)13-17-16-12-8-14-5-6-18(12)13/h1-6,8,11,15H,7H2.
What are the key properties of 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine?
3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 237.27 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydro-1H-indol-2-yl)-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 43479044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).