1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine

C8H9N5 — CID 131184068

IUPAC1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine
SMILESCc1ncccc1-n1cnc(N)n1
InChIInChI=1S/C8H9N5/c1-6-7(3-2-4-10-6)13-5-11-8(9)12-13/h2-5H,1H3,(H2,9,12)
InChIKeyUCOPUUMAMHYMQV-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.55
Rot. Bonds1

About 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine

1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine (PubChem CID 131184068) has the molecular formula C8H9N5 and a molecular weight of 175.19 g/mol. Its IUPAC name is 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine.

Molecular Properties

Compound Name1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine
PubChem CID131184068
Molecular FormulaC8H9N5
Molecular Weight175.19 g/mol
Exact Mass175.09
IUPAC Name1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine
SMILESCc1ncccc1-n1cnc(N)n1
InChIInChI=1S/C8H9N5/c1-6-7(3-2-4-10-6)13-5-11-8(9)12-13/h2-5H,1H3,(H2,9,12)
InChIKeyUCOPUUMAMHYMQV-UHFFFAOYSA-N
XLogP0.55
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine with MolForge

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

Launch Full Analysis

Related Compounds

1-(2-fluorophenyl)-1,2,4-triazol-3-amine
CID 115015063
2-methylpyridin-3-amine;hydroiodide
CID 172837374
azane;2-methylpyridin-3-amine
CID 67996717
3-(aziridin-1-yl)-2-methylpyridine
CID 54398386
2-(3-amino-1,2,4-triazol-1-yl)benzenesulfonamide
CID 61176788
2-methyl-3-(2-methyl-1,2,4-triazol-2-ium-1-yl)pyridine
CID 123392680
1-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-amine
CID 62314005
3-(3-chloro-1,2,4-triazol-1-yl)pyridin-2-amine
CID 130019418
2-methyl-3-(2-methylpyrazol-2-ium-1-yl)pyridine
CID 123148844
carbon dioxide;2-methylpyridin-3-amine
CID 157100546
2-(3-amino-1,2,4-triazol-1-yl)-N-propan-2-ylbenzenesulfonamide
CID 61176965
8-(3-methyl-1,2,4-triazol-1-yl)quinoline
CID 166607439

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine?
The IUPAC name of 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine (CID 131184068) is 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine.
What is the SMILES notation for 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine?
The canonical SMILES for 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine is Cc1ncccc1-n1cnc(N)n1.
What is the InChIKey of 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine?
The InChIKey is UCOPUUMAMHYMQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5/c1-6-7(3-2-4-10-6)13-5-11-8(9)12-13/h2-5H,1H3,(H2,9,12).
What are the key properties of 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine?
1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine has a molecular weight of 175.19 g/mol, XLogP of 0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-pyridinyl)-1,2,4-triazol-3-amine is sourced from PubChem (CID 131184068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).