2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine

C11H19N5 — CID 64575348

IUPAC2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine
SMILESNC1CCCCC1N1CCn2cnnc2C1
InChIInChI=1S/C11H19N5/c12-9-3-1-2-4-10(9)15-5-6-16-8-13-14-11(16)7-15/h8-10H,1-7,12H2
InChIKeyPWBLMUOCKIQKOH-UHFFFAOYSA-N
MW221.31 g/mol
LogP0.36
Rot. Bonds1

About 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine

2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine (PubChem CID 64575348) has the molecular formula C11H19N5 and a molecular weight of 221.31 g/mol. Its IUPAC name is 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine
PubChem CID64575348
Molecular FormulaC11H19N5
Molecular Weight221.31 g/mol
Exact Mass221.16
IUPAC Name2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine
SMILESNC1CCCCC1N1CCn2cnnc2C1
InChIInChI=1S/C11H19N5/c12-9-3-1-2-4-10(9)15-5-6-16-8-13-14-11(16)7-15/h8-10H,1-7,12H2
InChIKeyPWBLMUOCKIQKOH-UHFFFAOYSA-N
XLogP0.36
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine?
The IUPAC name of 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine (CID 64575348) is 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine.
What is the SMILES notation for 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine?
The canonical SMILES for 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine is NC1CCCCC1N1CCn2cnnc2C1.
What is the InChIKey of 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine?
The InChIKey is PWBLMUOCKIQKOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5/c12-9-3-1-2-4-10(9)15-5-6-16-8-13-14-11(16)7-15/h8-10H,1-7,12H2.
What are the key properties of 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine?
2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine has a molecular weight of 221.31 g/mol, XLogP of 0.36, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)cyclohexan-1-amine is sourced from PubChem (CID 64575348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).