3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine

C24H24FN5O — CID 71253961

IUPAC3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
SMILESFc1ccccc1-c1n[nH]c2cnc(-c3cnccc3OCCC3CCNCC3)cc12
InChIInChI=1S/C24H24FN5O/c25-20-4-2-1-3-17(20)24-18-13-21(28-15-22(18)29-30-24)19-14-27-11-7-23(19)31-12-8-16-5-9-26-10-6-16/h1-4,7,11,13-16,26H,5-6,8-10,12H2,(H,29,30)
InChIKeyJQNYZHASKGVLDO-UHFFFAOYSA-N
MW417.49 g/mol
LogP4.59
Rot. Bonds6

About 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine

3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine (PubChem CID 71253961) has the molecular formula C24H24FN5O and a molecular weight of 417.49 g/mol. Its IUPAC name is 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine.

Molecular Properties

Compound Name3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
PubChem CID71253961
Molecular FormulaC24H24FN5O
Molecular Weight417.49 g/mol
Exact Mass417.20
IUPAC Name3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
SMILESFc1ccccc1-c1n[nH]c2cnc(-c3cnccc3OCCC3CCNCC3)cc12
InChIInChI=1S/C24H24FN5O/c25-20-4-2-1-3-17(20)24-18-13-21(28-15-22(18)29-30-24)19-14-27-11-7-23(19)31-12-8-16-5-9-26-10-6-16/h1-4,7,11,13-16,26H,5-6,8-10,12H2,(H,29,30)
InChIKeyJQNYZHASKGVLDO-UHFFFAOYSA-N
XLogP4.59
TPSA75.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.49
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine with MolForge

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Related Compounds

3-[(2S)-2-amino-3-[3-(trifluoromethyl)phenyl]propoxy]-5-{3-methyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 11327794
3-[(2S)-2-amino-3-[(5-{1H-pyrazolo[3,4-c]pyridin-5-yl}pyridin-3-yl)oxy]propyl]-1H-indole
CID 16040274
3-[(2S)-2-amino-3-[(5-{3-methyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridin-3-yl)oxy]propyl]-1H-indole
CID 23647380
3-[(2S)-2-amino-3-phenylpropoxy]-5-{3-methyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 23647437
5-(1-methylpyrazol-4-yl)-3-[6-[(3R)-piperidin-3-yl]oxy-2-pyridinyl]-1H-pyrazolo[3,4-c]pyridine
CID 71253513
3-[(2S)-2-amino-3-[3-(trifluoromethyl)phenyl]propoxy]-5-{1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 16731838
3-[(2S)-2-amino-3-(2,3-difluorophenyl)propoxy]-5-{3-methyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 16731841
3-[(2S)-2-amino-3-phenylpropoxy]-5-{1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 23647436
3-[(2S)-2-amino-3-phenylpropoxy]-5-{3-chloro-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 23647438
3-[(2S)-2-amino-3-phenylpropoxy]-5-{3-ethenyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 23647440
3-[(2S)-2-amino-3-phenylpropoxy]-5-[3-(1-methyl-1H-pyrrol-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridine
CID 23647442
3-[(2S)-2-amino-3-phenylpropoxy]-5-{3-phenyl-1H-pyrazolo[3,4-c]pyridin-5-yl}pyridine
CID 23647443

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine?
The IUPAC name of 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine (CID 71253961) is 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine.
What is the SMILES notation for 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine?
The canonical SMILES for 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine is Fc1ccccc1-c1n[nH]c2cnc(-c3cnccc3OCCC3CCNCC3)cc12.
What is the InChIKey of 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine?
The InChIKey is JQNYZHASKGVLDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN5O/c25-20-4-2-1-3-17(20)24-18-13-21(28-15-22(18)29-30-24)19-14-27-11-7-23(19)31-12-8-16-5-9-26-10-6-16/h1-4,7,11,13-16,26H,5-6,8-10,12H2,(H,29,30).
What are the key properties of 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine?
3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine has a molecular weight of 417.49 g/mol, XLogP of 4.59, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluorophenyl)-5-[4-(2-piperidin-4-ylethoxy)-3-pyridinyl]-1H-pyrazolo[3,4-c]pyridine is sourced from PubChem (CID 71253961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).