[1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol

C19H14FN3O — CID 67005631

IUPAC[1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol
SMILESOC(c1ccncc1)c1ccc2c(cnn2-c2ccc(F)cc2)c1
InChIInChI=1S/C19H14FN3O/c20-16-2-4-17(5-3-16)23-18-6-1-14(11-15(18)12-22-23)19(24)13-7-9-21-10-8-13/h1-12,19,24H
InChIKeyZNESLSFNEIRKHE-UHFFFAOYSA-N
MW319.34 g/mol
LogP3.64
Rot. Bonds3

About [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol

[1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol (PubChem CID 67005631) has the molecular formula C19H14FN3O and a molecular weight of 319.34 g/mol. Its IUPAC name is [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol.

Molecular Properties

Compound Name[1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol
PubChem CID67005631
Molecular FormulaC19H14FN3O
Molecular Weight319.34 g/mol
Exact Mass319.11
IUPAC Name[1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol
SMILESOC(c1ccncc1)c1ccc2c(cnn2-c2ccc(F)cc2)c1
InChIInChI=1S/C19H14FN3O/c20-16-2-4-17(5-3-16)23-18-6-1-14(11-15(18)12-22-23)19(24)13-7-9-21-10-8-13/h1-12,19,24H
InChIKeyZNESLSFNEIRKHE-UHFFFAOYSA-N
XLogP3.64
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.34
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol?
The IUPAC name of [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol (CID 67005631) is [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol.
What is the SMILES notation for [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol?
The canonical SMILES for [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol is OC(c1ccncc1)c1ccc2c(cnn2-c2ccc(F)cc2)c1.
What is the InChIKey of [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol?
The InChIKey is ZNESLSFNEIRKHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN3O/c20-16-2-4-17(5-3-16)23-18-6-1-14(11-15(18)12-22-23)19(24)13-7-9-21-10-8-13/h1-12,19,24H.
What are the key properties of [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol?
[1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol has a molecular weight of 319.34 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorophenyl)indazol-5-yl]-pyridin-4-ylmethanol is sourced from PubChem (CID 67005631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).