[4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol

C15H12FN3O — CID 71710905

IUPAC[4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol
SMILESOCc1cc(-c2cn[nH]c2-c2ccc(F)cc2)ccn1
InChIInChI=1S/C15H12FN3O/c16-12-3-1-10(2-4-12)15-14(8-18-19-15)11-5-6-17-13(7-11)9-20/h1-8,20H,9H2,(H,18,19)
InChIKeyRKBVIYAYFDBXIL-UHFFFAOYSA-N
MW269.28 g/mol
LogP2.77
Rot. Bonds3

About [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol

[4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol (PubChem CID 71710905) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol
PubChem CID71710905
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name[4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol
SMILESOCc1cc(-c2cn[nH]c2-c2ccc(F)cc2)ccn1
InChIInChI=1S/C15H12FN3O/c16-12-3-1-10(2-4-12)15-14(8-18-19-15)11-5-6-17-13(7-11)9-20/h1-8,20H,9H2,(H,18,19)
InChIKeyRKBVIYAYFDBXIL-UHFFFAOYSA-N
XLogP2.77
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol?
The IUPAC name of [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol (CID 71710905) is [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol.
What is the SMILES notation for [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol?
The canonical SMILES for [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol is OCc1cc(-c2cn[nH]c2-c2ccc(F)cc2)ccn1.
What is the InChIKey of [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol?
The InChIKey is RKBVIYAYFDBXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c16-12-3-1-10(2-4-12)15-14(8-18-19-15)11-5-6-17-13(7-11)9-20/h1-8,20H,9H2,(H,18,19).
What are the key properties of [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol?
[4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol has a molecular weight of 269.28 g/mol, XLogP of 2.77, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]-2-pyridinyl]methanol is sourced from PubChem (CID 71710905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).