2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid

C10H14F3N3O2 — CID 86700289

IUPAC2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid
SMILESCc1c2c(nn1C)CCNC2.O=C(O)C(F)(F)F
InChIInChI=1S/C8H13N3.C2HF3O2/c1-6-7-5-9-4-3-8(7)10-11(6)2;3-2(4,5)1(6)7/h9H,3-5H2,1-2H3;(H,6,7)
InChIKeyOFRTUUYHPYKELK-UHFFFAOYSA-N
MW265.23 g/mol
LogP1.01
Rot. Bonds

About 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid

2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid (PubChem CID 86700289) has the molecular formula C10H14F3N3O2 and a molecular weight of 265.23 g/mol. Its IUPAC name is 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid.

Molecular Properties

Compound Name2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid
PubChem CID86700289
Molecular FormulaC10H14F3N3O2
Molecular Weight265.23 g/mol
Exact Mass265.10
IUPAC Name2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid
SMILESCc1c2c(nn1C)CCNC2.O=C(O)C(F)(F)F
InChIInChI=1S/C8H13N3.C2HF3O2/c1-6-7-5-9-4-3-8(7)10-11(6)2;3-2(4,5)1(6)7/h9H,3-5H2,1-2H3;(H,6,7)
InChIKeyOFRTUUYHPYKELK-UHFFFAOYSA-N
XLogP1.01
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.23
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid 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 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid?
The IUPAC name of 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid (CID 86700289) is 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid.
What is the SMILES notation for 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid?
The canonical SMILES for 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid is Cc1c2c(nn1C)CCNC2.O=C(O)C(F)(F)F.
What is the InChIKey of 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid?
The InChIKey is OFRTUUYHPYKELK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3.C2HF3O2/c1-6-7-5-9-4-3-8(7)10-11(6)2;3-2(4,5)1(6)7/h9H,3-5H2,1-2H3;(H,6,7).
What are the key properties of 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid?
2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid has a molecular weight of 265.23 g/mol, XLogP of 1.01, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine;2,2,2-trifluoroacetic acid is sourced from PubChem (CID 86700289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).