4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine

C24H15FN6 — CID 137019406

IUPAC4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine
SMILESFc1ccccc1-c1nccc2[nH]c(-c3n[nH]c4ccc(-c5cccnc5)cc34)nc12
InChIInChI=1S/C24H15FN6/c25-18-6-2-1-5-16(18)21-23-20(9-11-27-21)28-24(29-23)22-17-12-14(7-8-19(17)30-31-22)15-4-3-10-26-13-15/h1-13H,(H,28,29)(H,30,31)
InChIKeyJECIYEFVZCZCOK-UHFFFAOYSA-N
MW406.42 g/mol
LogP5.37
Rot. Bonds3

About 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine

4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine (PubChem CID 137019406) has the molecular formula C24H15FN6 and a molecular weight of 406.42 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine
PubChem CID137019406
Molecular FormulaC24H15FN6
Molecular Weight406.42 g/mol
Exact Mass406.13
IUPAC Name4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine
SMILESFc1ccccc1-c1nccc2[nH]c(-c3n[nH]c4ccc(-c5cccnc5)cc34)nc12
InChIInChI=1S/C24H15FN6/c25-18-6-2-1-5-16(18)21-23-20(9-11-27-21)28-24(29-23)22-17-12-14(7-8-19(17)30-31-22)15-4-3-10-26-13-15/h1-13H,(H,28,29)(H,30,31)
InChIKeyJECIYEFVZCZCOK-UHFFFAOYSA-N
XLogP5.37
TPSA83.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms31
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500406.42
LogP ≤ 55.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine?
The IUPAC name of 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine (CID 137019406) is 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine?
The canonical SMILES for 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine is Fc1ccccc1-c1nccc2[nH]c(-c3n[nH]c4ccc(-c5cccnc5)cc34)nc12.
What is the InChIKey of 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine?
The InChIKey is JECIYEFVZCZCOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H15FN6/c25-18-6-2-1-5-16(18)21-23-20(9-11-27-21)28-24(29-23)22-17-12-14(7-8-19(17)30-31-22)15-4-3-10-26-13-15/h1-13H,(H,28,29)(H,30,31).
What are the key properties of 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine?
4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine has a molecular weight of 406.42 g/mol, XLogP of 5.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-2-(5-pyridin-3-yl-1H-indazol-3-yl)-1H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 137019406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).