1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol

C8H10F3N3O — CID 144505397

IUPAC1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol
SMILESNn1nc(C(F)(F)F)c2c1CCC(O)C2
InChIInChI=1S/C8H10F3N3O/c9-8(10,11)7-5-3-4(15)1-2-6(5)14(12)13-7/h4,15H,1-3,12H2
InChIKeyUUFCYMQRBJTWQE-UHFFFAOYSA-N
MW221.18 g/mol
LogP0.47
Rot. Bonds

About 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol

1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol (PubChem CID 144505397) has the molecular formula C8H10F3N3O and a molecular weight of 221.18 g/mol. Its IUPAC name is 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol.

Molecular Properties

Compound Name1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol
PubChem CID144505397
Molecular FormulaC8H10F3N3O
Molecular Weight221.18 g/mol
Exact Mass221.08
IUPAC Name1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol
SMILESNn1nc(C(F)(F)F)c2c1CCC(O)C2
InChIInChI=1S/C8H10F3N3O/c9-8(10,11)7-5-3-4(15)1-2-6(5)14(12)13-7/h4,15H,1-3,12H2
InChIKeyUUFCYMQRBJTWQE-UHFFFAOYSA-N
XLogP0.47
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.18
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol 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 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol?
The IUPAC name of 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol (CID 144505397) is 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol.
What is the SMILES notation for 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol?
The canonical SMILES for 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol is Nn1nc(C(F)(F)F)c2c1CCC(O)C2.
What is the InChIKey of 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol?
The InChIKey is UUFCYMQRBJTWQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N3O/c9-8(10,11)7-5-3-4(15)1-2-6(5)14(12)13-7/h4,15H,1-3,12H2.
What are the key properties of 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol?
1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol has a molecular weight of 221.18 g/mol, XLogP of 0.47, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-5-ol is sourced from PubChem (CID 144505397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).