1-(4-fluorophenyl)-2-pyridin-4-ylethanol

C13H12FNO — CID 62553094

IUPAC1-(4-fluorophenyl)-2-pyridin-4-ylethanol
SMILESOC(Cc1ccncc1)c1ccc(F)cc1
InChIInChI=1S/C13H12FNO/c14-12-3-1-11(2-4-12)13(16)9-10-5-7-15-8-6-10/h1-8,13,16H,9H2
InChIKeyHGHGPEZNEPVLIW-UHFFFAOYSA-N
MW217.24 g/mol
LogP2.50
Rot. Bonds3

About 1-(4-fluorophenyl)-2-pyridin-4-ylethanol

1-(4-fluorophenyl)-2-pyridin-4-ylethanol (PubChem CID 62553094) has the molecular formula C13H12FNO and a molecular weight of 217.24 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-2-pyridin-4-ylethanol.

Molecular Properties

Compound Name1-(4-fluorophenyl)-2-pyridin-4-ylethanol
PubChem CID62553094
Molecular FormulaC13H12FNO
Molecular Weight217.24 g/mol
Exact Mass217.09
IUPAC Name1-(4-fluorophenyl)-2-pyridin-4-ylethanol
SMILESOC(Cc1ccncc1)c1ccc(F)cc1
InChIInChI=1S/C13H12FNO/c14-12-3-1-11(2-4-12)13(16)9-10-5-7-15-8-6-10/h1-8,13,16H,9H2
InChIKeyHGHGPEZNEPVLIW-UHFFFAOYSA-N
XLogP2.50
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.24
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-2-pyridin-4-ylethanol?
The IUPAC name of 1-(4-fluorophenyl)-2-pyridin-4-ylethanol (CID 62553094) is 1-(4-fluorophenyl)-2-pyridin-4-ylethanol.
What is the SMILES notation for 1-(4-fluorophenyl)-2-pyridin-4-ylethanol?
The canonical SMILES for 1-(4-fluorophenyl)-2-pyridin-4-ylethanol is OC(Cc1ccncc1)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)-2-pyridin-4-ylethanol?
The InChIKey is HGHGPEZNEPVLIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO/c14-12-3-1-11(2-4-12)13(16)9-10-5-7-15-8-6-10/h1-8,13,16H,9H2.
What are the key properties of 1-(4-fluorophenyl)-2-pyridin-4-ylethanol?
1-(4-fluorophenyl)-2-pyridin-4-ylethanol has a molecular weight of 217.24 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-2-pyridin-4-ylethanol is sourced from PubChem (CID 62553094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).