3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

C17H15FN4 — CID 91819625

IUPAC3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESFc1ccc(-c2n[nH]c3c2CN(c2ccccn2)CC3)cc1
InChIInChI=1S/C17H15FN4/c18-13-6-4-12(5-7-13)17-14-11-22(10-8-15(14)20-21-17)16-3-1-2-9-19-16/h1-7,9H,8,10-11H2,(H,20,21)
InChIKeyZJRNBCJAMQCQNC-UHFFFAOYSA-N
MW294.33 g/mol
LogP3.17
Rot. Bonds2

About 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine

3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine (PubChem CID 91819625) has the molecular formula C17H15FN4 and a molecular weight of 294.33 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
PubChem CID91819625
Molecular FormulaC17H15FN4
Molecular Weight294.33 g/mol
Exact Mass294.13
IUPAC Name3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine
SMILESFc1ccc(-c2n[nH]c3c2CN(c2ccccn2)CC3)cc1
InChIInChI=1S/C17H15FN4/c18-13-6-4-12(5-7-13)17-14-11-22(10-8-15(14)20-21-17)16-3-1-2-9-19-16/h1-7,9H,8,10-11H2,(H,20,21)
InChIKeyZJRNBCJAMQCQNC-UHFFFAOYSA-N
XLogP3.17
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The IUPAC name of 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine (CID 91819625) is 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine.
What is the SMILES notation for 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The canonical SMILES for 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine is Fc1ccc(-c2n[nH]c3c2CN(c2ccccn2)CC3)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
The InChIKey is ZJRNBCJAMQCQNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN4/c18-13-6-4-12(5-7-13)17-14-11-22(10-8-15(14)20-21-17)16-3-1-2-9-19-16/h1-7,9H,8,10-11H2,(H,20,21).
What are the key properties of 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine?
3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine has a molecular weight of 294.33 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-5-pyridin-2-yl-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridine is sourced from PubChem (CID 91819625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).