3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol

C15H14F2O2 — CID 53434345

IUPAC3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol
SMILESOCCCc1ccccc1Oc1ccc(F)c(F)c1
InChIInChI=1S/C15H14F2O2/c16-13-8-7-12(10-14(13)17)19-15-6-2-1-4-11(15)5-3-9-18/h1-2,4,6-8,10,18H,3,5,9H2
InChIKeyXJNKMWNGYHBOCR-UHFFFAOYSA-N
MW264.27 g/mol
LogP3.68
Rot. Bonds5

About 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol

3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol (PubChem CID 53434345) has the molecular formula C15H14F2O2 and a molecular weight of 264.27 g/mol. Its IUPAC name is 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol.

Molecular Properties

Compound Name3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol
PubChem CID53434345
Molecular FormulaC15H14F2O2
Molecular Weight264.27 g/mol
Exact Mass264.10
IUPAC Name3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol
SMILESOCCCc1ccccc1Oc1ccc(F)c(F)c1
InChIInChI=1S/C15H14F2O2/c16-13-8-7-12(10-14(13)17)19-15-6-2-1-4-11(15)5-3-9-18/h1-2,4,6-8,10,18H,3,5,9H2
InChIKeyXJNKMWNGYHBOCR-UHFFFAOYSA-N
XLogP3.68
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[2-(3,4-difluorophenoxy)phenyl]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

3-[2-(3,4-difluorophenoxy)phenyl]propan-1-amine
CID 53434344
N-[[2-(3,4-difluorophenoxy)phenyl]methyl]propan-2-amine
CID 43554911
[2-(3-bromo-4-fluorophenoxy)phenyl]methanol
CID 83235131
(2S)-2-amino-2-[2-(3,4-difluorophenoxy)phenyl]ethanol
CID 66515923
1-[2-(3,4-difluorophenoxy)phenyl]-3-(1,3-thiazol-2-yl)propan-2-one
CID 58541250
2-(3,4-difluorophenoxy)benzonitrile
CID 43429840
4-[3-[2-(4-chloro-3-fluorophenoxy)phenyl]propyl]morpholine
CID 170870231
4-[2-(bromomethyl)phenoxy]-1-fluoro-2-methylbenzene
CID 107088974
3-(4-chloro-2-fluorophenyl)propan-1-ol
CID 53425229
ethyl 2-(3,4-difluorophenoxy)benzoate
CID 175272248
2-[2-[3-(aminomethyl)-5-fluorophenoxy]phenyl]ethanol
CID 107711745
3-(2-phenoxyphenyl)propan-1-amine;phosphane
CID 175469418

Frequently Asked Questions

What is the IUPAC name of 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol?
The IUPAC name of 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol (CID 53434345) is 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol.
What is the SMILES notation for 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol?
The canonical SMILES for 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol is OCCCc1ccccc1Oc1ccc(F)c(F)c1.
What is the InChIKey of 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol?
The InChIKey is XJNKMWNGYHBOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O2/c16-13-8-7-12(10-14(13)17)19-15-6-2-1-4-11(15)5-3-9-18/h1-2,4,6-8,10,18H,3,5,9H2.
What are the key properties of 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol?
3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol has a molecular weight of 264.27 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(3,4-difluorophenoxy)phenyl]propan-1-ol is sourced from PubChem (CID 53434345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).