[6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol

C19H14Cl2FNO2 — CID 146243569

IUPAC[6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol
SMILESOCc1cc(-c2cc(Cl)cc(Cl)c2)nc(OCc2ccccc2)c1F
InChIInChI=1S/C19H14Cl2FNO2/c20-15-6-13(7-16(21)9-15)17-8-14(10-24)18(22)19(23-17)25-11-12-4-2-1-3-5-12/h1-9,24H,10-11H2
InChIKeyFHPXBFMESOWALK-UHFFFAOYSA-N
MW378.23 g/mol
LogP5.27
Rot. Bonds5

About [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol

[6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol (PubChem CID 146243569) has the molecular formula C19H14Cl2FNO2 and a molecular weight of 378.23 g/mol. Its IUPAC name is [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol
PubChem CID146243569
Molecular FormulaC19H14Cl2FNO2
Molecular Weight378.23 g/mol
Exact Mass377.04
IUPAC Name[6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol
SMILESOCc1cc(-c2cc(Cl)cc(Cl)c2)nc(OCc2ccccc2)c1F
InChIInChI=1S/C19H14Cl2FNO2/c20-15-6-13(7-16(21)9-15)17-8-14(10-24)18(22)19(23-17)25-11-12-4-2-1-3-5-12/h1-9,24H,10-11H2
InChIKeyFHPXBFMESOWALK-UHFFFAOYSA-N
XLogP5.27
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500378.23
LogP ≤ 55.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol?
The IUPAC name of [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol (CID 146243569) is [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol.
What is the SMILES notation for [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol?
The canonical SMILES for [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol is OCc1cc(-c2cc(Cl)cc(Cl)c2)nc(OCc2ccccc2)c1F.
What is the InChIKey of [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol?
The InChIKey is FHPXBFMESOWALK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2FNO2/c20-15-6-13(7-16(21)9-15)17-8-14(10-24)18(22)19(23-17)25-11-12-4-2-1-3-5-12/h1-9,24H,10-11H2.
What are the key properties of [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol?
[6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol has a molecular weight of 378.23 g/mol, XLogP of 5.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,5-dichlorophenyl)-3-fluoro-2-phenylmethoxy-4-pyridinyl]methanol is sourced from PubChem (CID 146243569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).