1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol

C14H15FO2 — CID 105094003

IUPAC1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol
SMILESCc1cc(C(O)CCc2ccco2)ccc1F
InChIInChI=1S/C14H15FO2/c1-10-9-11(4-6-13(10)15)14(16)7-5-12-3-2-8-17-12/h2-4,6,8-9,14,16H,5,7H2,1H3
InChIKeyJRCKQSXLXFSOJR-UHFFFAOYSA-N
MW234.27 g/mol
LogP3.39
Rot. Bonds4

About 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol

1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol (PubChem CID 105094003) has the molecular formula C14H15FO2 and a molecular weight of 234.27 g/mol. Its IUPAC name is 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol.

Molecular Properties

Compound Name1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol
PubChem CID105094003
Molecular FormulaC14H15FO2
Molecular Weight234.27 g/mol
Exact Mass234.11
IUPAC Name1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol
SMILESCc1cc(C(O)CCc2ccco2)ccc1F
InChIInChI=1S/C14H15FO2/c1-10-9-11(4-6-13(10)15)14(16)7-5-12-3-2-8-17-12/h2-4,6,8-9,14,16H,5,7H2,1H3
InChIKeyJRCKQSXLXFSOJR-UHFFFAOYSA-N
XLogP3.39
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.27
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)-N-propylpropan-1-amine
CID 105143097
(R)-(4-fluoro-3-methylphenyl)-(furan-2-yl)methanol
CID 94602014
1-(3,4-diethoxyphenyl)-3-(furan-2-yl)propan-1-ol
CID 105094403
(1S)-1-(3,4-dimethylphenyl)-3-(furan-2-yl)propan-1-amine
CID 40511217
1-(2-fluorophenyl)-3-(furan-2-yl)propan-1-ol
CID 105083868
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(furan-2-yl)propan-1-ol
CID 105094293
1-(2,3-difluorophenyl)-3-(furan-2-yl)propan-1-ol
CID 105099638
1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-one
CID 105095849
[1-(3,4-dimethylphenyl)-3-(furan-2-yl)propyl]hydrazine
CID 105300181
N-[1-(4-fluoro-3-methylphenyl)-2-(furan-2-yl)ethyl]propan-1-amine
CID 83175003
(1R)-2-chloro-1-(4-fluoro-3-methylphenyl)ethanol
CID 93182268
1-(4-fluoro-3-methylphenyl)-3-phenoxypropan-1-ol
CID 62608597

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol?
The IUPAC name of 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol (CID 105094003) is 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol.
What is the SMILES notation for 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol?
The canonical SMILES for 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol is Cc1cc(C(O)CCc2ccco2)ccc1F.
What is the InChIKey of 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol?
The InChIKey is JRCKQSXLXFSOJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FO2/c1-10-9-11(4-6-13(10)15)14(16)7-5-12-3-2-8-17-12/h2-4,6,8-9,14,16H,5,7H2,1H3.
What are the key properties of 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol?
1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol has a molecular weight of 234.27 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-3-methylphenyl)-3-(furan-2-yl)propan-1-ol is sourced from PubChem (CID 105094003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).