2-propyl-4,5,6,7-tetrahydroindazol-7-amine

C10H17N3 — CID 104704114

IUPAC2-propyl-4,5,6,7-tetrahydroindazol-7-amine
SMILESCCCn1cc2c(n1)C(N)CCC2
InChIInChI=1S/C10H17N3/c1-2-6-13-7-8-4-3-5-9(11)10(8)12-13/h7,9H,2-6,11H2,1H3
InChIKeyXIELTVVZODYEPC-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.63
Rot. Bonds2

About 2-propyl-4,5,6,7-tetrahydroindazol-7-amine

2-propyl-4,5,6,7-tetrahydroindazol-7-amine (PubChem CID 104704114) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 2-propyl-4,5,6,7-tetrahydroindazol-7-amine.

Molecular Properties

Compound Name2-propyl-4,5,6,7-tetrahydroindazol-7-amine
PubChem CID104704114
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name2-propyl-4,5,6,7-tetrahydroindazol-7-amine
SMILESCCCn1cc2c(n1)C(N)CCC2
InChIInChI=1S/C10H17N3/c1-2-6-13-7-8-4-3-5-9(11)10(8)12-13/h7,9H,2-6,11H2,1H3
InChIKeyXIELTVVZODYEPC-UHFFFAOYSA-N
XLogP1.63
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-propyl-4,5,6,7-tetrahydroindazol-7-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-propyl-4,5,6,7-tetrahydroindazol-7-amine?
The IUPAC name of 2-propyl-4,5,6,7-tetrahydroindazol-7-amine (CID 104704114) is 2-propyl-4,5,6,7-tetrahydroindazol-7-amine.
What is the SMILES notation for 2-propyl-4,5,6,7-tetrahydroindazol-7-amine?
The canonical SMILES for 2-propyl-4,5,6,7-tetrahydroindazol-7-amine is CCCn1cc2c(n1)C(N)CCC2.
What is the InChIKey of 2-propyl-4,5,6,7-tetrahydroindazol-7-amine?
The InChIKey is XIELTVVZODYEPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-2-6-13-7-8-4-3-5-9(11)10(8)12-13/h7,9H,2-6,11H2,1H3.
What are the key properties of 2-propyl-4,5,6,7-tetrahydroindazol-7-amine?
2-propyl-4,5,6,7-tetrahydroindazol-7-amine has a molecular weight of 179.27 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propyl-4,5,6,7-tetrahydroindazol-7-amine is sourced from PubChem (CID 104704114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).