2-methylindazol-4-amine

C8H9N3 — CID 15413170

IUPAC2-methylindazol-4-amine
SMILESCn1cc2c(N)cccc2n1
InChIInChI=1S/C8H9N3/c1-11-5-6-7(9)3-2-4-8(6)10-11/h2-5H,9H2,1H3
InChIKeyRMCAMILOUFSNOR-UHFFFAOYSA-N
MW147.18 g/mol
LogP1.16
Rot. Bonds

About 2-methylindazol-4-amine

2-methylindazol-4-amine (PubChem CID 15413170) has the molecular formula C8H9N3 and a molecular weight of 147.18 g/mol. Its IUPAC name is 2-methylindazol-4-amine.

Molecular Properties

Compound Name2-methylindazol-4-amine
PubChem CID15413170
Molecular FormulaC8H9N3
Molecular Weight147.18 g/mol
Exact Mass147.08
IUPAC Name2-methylindazol-4-amine
SMILESCn1cc2c(N)cccc2n1
InChIInChI=1S/C8H9N3/c1-11-5-6-7(9)3-2-4-8(6)10-11/h2-5H,9H2,1H3
InChIKeyRMCAMILOUFSNOR-UHFFFAOYSA-N
XLogP1.16
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze 2-methylindazol-4-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-methylindazol-4-amine?
The IUPAC name of 2-methylindazol-4-amine (CID 15413170) is 2-methylindazol-4-amine.
What is the SMILES notation for 2-methylindazol-4-amine?
The canonical SMILES for 2-methylindazol-4-amine is Cn1cc2c(N)cccc2n1.
What is the InChIKey of 2-methylindazol-4-amine?
The InChIKey is RMCAMILOUFSNOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3/c1-11-5-6-7(9)3-2-4-8(6)10-11/h2-5H,9H2,1H3.
What are the key properties of 2-methylindazol-4-amine?
2-methylindazol-4-amine has a molecular weight of 147.18 g/mol, XLogP of 1.16, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylindazol-4-amine is sourced from PubChem (CID 15413170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).