2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine

C7H9N5 — CID 12603825

IUPAC2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
SMILESCc1cc2nc(C)nn2c(N)n1
InChIInChI=1S/C7H9N5/c1-4-3-6-10-5(2)11-12(6)7(8)9-4/h3H,1-2H3,(H2,8,9)
InChIKeyGXLKQIGWDGNADR-UHFFFAOYSA-N
MW163.18 g/mol
LogP0.32
Rot. Bonds

About 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine

2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine (PubChem CID 12603825) has the molecular formula C7H9N5 and a molecular weight of 163.18 g/mol. Its IUPAC name is 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound Name2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
PubChem CID12603825
Molecular FormulaC7H9N5
Molecular Weight163.18 g/mol
Exact Mass163.09
IUPAC Name2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
SMILESCc1cc2nc(C)nn2c(N)n1
InChIInChI=1S/C7H9N5/c1-4-3-6-10-5(2)11-12(6)7(8)9-4/h3H,1-2H3,(H2,8,9)
InChIKeyGXLKQIGWDGNADR-UHFFFAOYSA-N
XLogP0.32
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.18
LogP ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-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 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The IUPAC name of 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine (CID 12603825) is 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine is Cc1cc2nc(C)nn2c(N)n1.
What is the InChIKey of 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
The InChIKey is GXLKQIGWDGNADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N5/c1-4-3-6-10-5(2)11-12(6)7(8)9-4/h3H,1-2H3,(H2,8,9).
What are the key properties of 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine?
2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine has a molecular weight of 163.18 g/mol, XLogP of 0.32, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 12603825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).