3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine

C20H19F2N3 — CID 141360491

IUPAC3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESC[C@@H](c1ccc(F)cc1)n1nc(-c2ccc(F)cc2)c2c1CCNC2
InChIInChI=1S/C20H19F2N3/c1-13(14-2-6-16(21)7-3-14)25-19-10-11-23-12-18(19)20(24-25)15-4-8-17(22)9-5-15/h2-9,13,23H,10-12H2,1H3/t13-/m0/s1
InChIKeyMNOKQZYBWZTKGF-ZDUSSCGKSA-N
MW339.39 g/mol
LogP4.08
Rot. Bonds3

About 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine

3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine (PubChem CID 141360491) has the molecular formula C20H19F2N3 and a molecular weight of 339.39 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
PubChem CID141360491
Molecular FormulaC20H19F2N3
Molecular Weight339.39 g/mol
Exact Mass339.15
IUPAC Name3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESC[C@@H](c1ccc(F)cc1)n1nc(-c2ccc(F)cc2)c2c1CCNC2
InChIInChI=1S/C20H19F2N3/c1-13(14-2-6-16(21)7-3-14)25-19-10-11-23-12-18(19)20(24-25)15-4-8-17(22)9-5-15/h2-9,13,23H,10-12H2,1H3/t13-/m0/s1
InChIKeyMNOKQZYBWZTKGF-ZDUSSCGKSA-N
XLogP4.08
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.39
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine 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 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The IUPAC name of 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine (CID 141360491) is 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine is C[C@@H](c1ccc(F)cc1)n1nc(-c2ccc(F)cc2)c2c1CCNC2.
What is the InChIKey of 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The InChIKey is MNOKQZYBWZTKGF-ZDUSSCGKSA-N. The full InChI is InChI=1S/C20H19F2N3/c1-13(14-2-6-16(21)7-3-14)25-19-10-11-23-12-18(19)20(24-25)15-4-8-17(22)9-5-15/h2-9,13,23H,10-12H2,1H3/t13-/m0/s1.
What are the key properties of 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine?
3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine has a molecular weight of 339.39 g/mol, XLogP of 4.08, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-4,5,6,7-tetrahydropyrazolo[4,3-c]pyridine is sourced from PubChem (CID 141360491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).