1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol

C14H13F2NO2 — CID 112585589

IUPAC1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol
SMILESCCC(O)c1ccc(Oc2cccc(F)c2F)cn1
InChIInChI=1S/C14H13F2NO2/c1-2-12(18)11-7-6-9(8-17-11)19-13-5-3-4-10(15)14(13)16/h3-8,12,18H,2H2,1H3
InChIKeyAGQYAQCVWGPUSB-UHFFFAOYSA-N
MW265.26 g/mol
LogP3.60
Rot. Bonds4

About 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol

1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol (PubChem CID 112585589) has the molecular formula C14H13F2NO2 and a molecular weight of 265.26 g/mol. Its IUPAC name is 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol.

Molecular Properties

Compound Name1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol
PubChem CID112585589
Molecular FormulaC14H13F2NO2
Molecular Weight265.26 g/mol
Exact Mass265.09
IUPAC Name1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol
SMILESCCC(O)c1ccc(Oc2cccc(F)c2F)cn1
InChIInChI=1S/C14H13F2NO2/c1-2-12(18)11-7-6-9(8-17-11)19-13-5-3-4-10(15)14(13)16/h3-8,12,18H,2H2,1H3
InChIKeyAGQYAQCVWGPUSB-UHFFFAOYSA-N
XLogP3.60
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.26
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R)-1-[5-(2,4-difluorophenoxy)-2-pyridinyl]propan-1-ol
CID 103939049
(1S)-1-(5-naphthalen-1-yloxy-2-pyridinyl)propan-1-ol
CID 103939118
1-(5-naphthalen-1-yloxy-2-pyridinyl)propan-1-ol
CID 115940536
(1S)-1-[5-(2-iodophenoxy)-2-pyridinyl]propan-1-ol
CID 103939168
(1S)-1-[5-(2-methoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 103939114
1-[5-(2,3-difluorophenoxy)-2-pyridinyl]-N-methylethanamine
CID 83123940
(1R)-1-[5-(4-fluoro-3-methylphenoxy)-2-pyridinyl]propan-1-ol
CID 103939285
(1S)-1-[5-(2-methyl-3-nitrophenoxy)-2-pyridinyl]propan-1-ol
CID 103939202
(1R)-1-[5-(3-methoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 103939075
(1S)-1-[5-(3-ethoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 103939228
1-[5-(4-methoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 112585568
(1S)-1-[5-(4-methoxyphenoxy)-2-pyridinyl]propan-1-ol
CID 103939120

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol?
The IUPAC name of 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol (CID 112585589) is 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol.
What is the SMILES notation for 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol?
The canonical SMILES for 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol is CCC(O)c1ccc(Oc2cccc(F)c2F)cn1.
What is the InChIKey of 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol?
The InChIKey is AGQYAQCVWGPUSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2NO2/c1-2-12(18)11-7-6-9(8-17-11)19-13-5-3-4-10(15)14(13)16/h3-8,12,18H,2H2,1H3.
What are the key properties of 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol?
1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol has a molecular weight of 265.26 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2,3-difluorophenoxy)-2-pyridinyl]propan-1-ol is sourced from PubChem (CID 112585589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).