4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol

C15H12FN3O — CID 135617031

IUPAC4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol
SMILESOc1cnccc1-c1cc(Cc2ccc(F)cc2)[nH]n1
InChIInChI=1S/C15H12FN3O/c16-11-3-1-10(2-4-11)7-12-8-14(19-18-12)13-5-6-17-9-15(13)20/h1-6,8-9,20H,7H2,(H,18,19)
InChIKeyHKKZRVWOCYWACC-UHFFFAOYSA-N
MW269.28 g/mol
LogP2.91
Rot. Bonds3

About 4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol

4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol (PubChem CID 135617031) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol.

Molecular Properties

Compound Name4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol
PubChem CID135617031
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol
SMILESOc1cnccc1-c1cc(Cc2ccc(F)cc2)[nH]n1
InChIInChI=1S/C15H12FN3O/c16-11-3-1-10(2-4-11)7-12-8-14(19-18-12)13-5-6-17-9-15(13)20/h1-6,8-9,20H,7H2,(H,18,19)
InChIKeyHKKZRVWOCYWACC-UHFFFAOYSA-N
XLogP2.91
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 ≤ 52.91
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)methyl]-1H-pyrazol-3-yl]pyridin-3-ol?
The IUPAC name of 4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol (CID 135617031) is 4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol.
What is the SMILES notation for 4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol?
The canonical SMILES for 4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol is Oc1cnccc1-c1cc(Cc2ccc(F)cc2)[nH]n1.
What is the InChIKey of 4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol?
The InChIKey is HKKZRVWOCYWACC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c16-11-3-1-10(2-4-11)7-12-8-14(19-18-12)13-5-6-17-9-15(13)20/h1-6,8-9,20H,7H2,(H,18,19).
What are the key properties of 4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol?
4-[5-[(4-fluorophenyl)methyl]-1H-pyrazol-3-yl]pyridin-3-ol has a molecular weight of 269.28 g/mol, XLogP of 2.91, 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)methyl]-1H-pyrazol-3-yl]pyridin-3-ol is sourced from PubChem (CID 135617031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).