1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine

C8H11N5 — CID 83874715

IUPAC1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine
SMILESCC(N)Cc1cnc2nnccn12
InChIInChI=1S/C8H11N5/c1-6(9)4-7-5-10-8-12-11-2-3-13(7)8/h2-3,5-6H,4,9H2,1H3
InChIKeyYFFXUFMXSRHWGY-UHFFFAOYSA-N
MW177.21 g/mol
LogP0.01
Rot. Bonds2

About 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine

1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine (PubChem CID 83874715) has the molecular formula C8H11N5 and a molecular weight of 177.21 g/mol. Its IUPAC name is 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine.

Molecular Properties

Compound Name1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine
PubChem CID83874715
Molecular FormulaC8H11N5
Molecular Weight177.21 g/mol
Exact Mass177.10
IUPAC Name1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine
SMILESCC(N)Cc1cnc2nnccn12
InChIInChI=1S/C8H11N5/c1-6(9)4-7-5-10-8-12-11-2-3-13(7)8/h2-3,5-6H,4,9H2,1H3
InChIKeyYFFXUFMXSRHWGY-UHFFFAOYSA-N
XLogP0.01
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine?
The IUPAC name of 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine (CID 83874715) is 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine.
What is the SMILES notation for 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine?
The canonical SMILES for 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine is CC(N)Cc1cnc2nnccn12.
What is the InChIKey of 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine?
The InChIKey is YFFXUFMXSRHWGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N5/c1-6(9)4-7-5-10-8-12-11-2-3-13(7)8/h2-3,5-6H,4,9H2,1H3.
What are the key properties of 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine?
1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine has a molecular weight of 177.21 g/mol, XLogP of 0.01, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-imidazo[2,1-c][1,2,4]triazin-6-ylpropan-2-amine is sourced from PubChem (CID 83874715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).