1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol

C15H16FNO2 — CID 105122276

IUPAC1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol
SMILESCOc1ccc(F)cc1C(O)CCc1ccncc1
InChIInChI=1S/C15H16FNO2/c1-19-15-5-3-12(16)10-13(15)14(18)4-2-11-6-8-17-9-7-11/h3,5-10,14,18H,2,4H2,1H3
InChIKeyLRBVBWJEOKMYJM-UHFFFAOYSA-N
MW261.30 g/mol
LogP2.90
Rot. Bonds5

About 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol

1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol (PubChem CID 105122276) has the molecular formula C15H16FNO2 and a molecular weight of 261.30 g/mol. Its IUPAC name is 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol.

Molecular Properties

Compound Name1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol
PubChem CID105122276
Molecular FormulaC15H16FNO2
Molecular Weight261.30 g/mol
Exact Mass261.12
IUPAC Name1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol
SMILESCOc1ccc(F)cc1C(O)CCc1ccncc1
InChIInChI=1S/C15H16FNO2/c1-19-15-5-3-12(16)10-13(15)14(18)4-2-11-6-8-17-9-7-11/h3,5-10,14,18H,2,4H2,1H3
InChIKeyLRBVBWJEOKMYJM-UHFFFAOYSA-N
XLogP2.90
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-fluoro-2-methoxyphenyl)-3-pyridin-2-ylpropan-1-ol
CID 105122398
1-(2-fluoro-4-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol
CID 103397475
(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
CID 79002413
3-pyridin-4-yl-1-[2-(trifluoromethoxy)phenyl]propan-1-ol
CID 105092807
3,3,3-trifluoro-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
CID 61087261
1-(5-chloro-2-methoxyphenyl)-2-pyridin-4-ylethanol
CID 55116184
1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutan-1-ol
CID 103027670
1-(2-fluoro-3-methoxyphenyl)-4-pyridin-4-ylbutan-2-ol
CID 105125656
5-(5-fluoro-2-methoxyphenyl)-5-hydroxy-N,N-dimethylpentanamide
CID 112511084
1-(5-chloro-2-methoxyphenyl)-3-pyridin-3-ylpropan-1-ol
CID 105092299
(1R)-1-(5-fluoro-2-methoxyphenyl)ethanol
CID 26597266
1-(5-fluoro-2-methylphenyl)-4-pyridin-4-ylbutan-2-ol
CID 105377685

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol?
The IUPAC name of 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol (CID 105122276) is 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol.
What is the SMILES notation for 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol?
The canonical SMILES for 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol is COc1ccc(F)cc1C(O)CCc1ccncc1.
What is the InChIKey of 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol?
The InChIKey is LRBVBWJEOKMYJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2/c1-19-15-5-3-12(16)10-13(15)14(18)4-2-11-6-8-17-9-7-11/h3,5-10,14,18H,2,4H2,1H3.
What are the key properties of 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol?
1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol has a molecular weight of 261.30 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-methoxyphenyl)-3-pyridin-4-ylpropan-1-ol is sourced from PubChem (CID 105122276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).