2-(4-fluoro-2-methoxyphenyl)propan-1-ol

C10H13FO2 — CID 105426240

IUPAC2-(4-fluoro-2-methoxyphenyl)propan-1-ol
SMILESCOc1cc(F)ccc1C(C)CO
InChIInChI=1S/C10H13FO2/c1-7(6-12)9-4-3-8(11)5-10(9)13-2/h3-5,7,12H,6H2,1-2H3
InChIKeyLEDOQFLBKKQRQB-UHFFFAOYSA-N
MW184.21 g/mol
LogP1.93
Rot. Bonds3

About 2-(4-fluoro-2-methoxyphenyl)propan-1-ol

2-(4-fluoro-2-methoxyphenyl)propan-1-ol (PubChem CID 105426240) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is 2-(4-fluoro-2-methoxyphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(4-fluoro-2-methoxyphenyl)propan-1-ol
PubChem CID105426240
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name2-(4-fluoro-2-methoxyphenyl)propan-1-ol
SMILESCOc1cc(F)ccc1C(C)CO
InChIInChI=1S/C10H13FO2/c1-7(6-12)9-4-3-8(11)5-10(9)13-2/h3-5,7,12H,6H2,1-2H3
InChIKeyLEDOQFLBKKQRQB-UHFFFAOYSA-N
XLogP1.93
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.21
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methoxy-4-methylphenyl)propan-1-ol
CID 14432753
(2R)-2-amino-2-(4-fluoro-2-methoxyphenyl)ethanol;hydrochloride
CID 171224919
1-(2,4-dimethylpentan-3-yl)-4-fluoro-2-methoxybenzene
CID 156645255
2-(5-fluoro-2-methoxyphenyl)propane-1,3-diol
CID 82112362
(1S,2R)-1-amino-1-(4-fluoro-2-methoxyphenyl)propan-2-ol;hydrochloride
CID 171270199
2-(3-bromo-2-fluoro-4-methoxyphenyl)propan-1-ol
CID 117411724
(1S)-1-(4-fluoro-2-methoxyphenyl)propan-1-amine
CID 55253804
[2-fluoro-4-[(2R)-1-hydroxypropan-2-yl]-5-methoxyphenyl]boronic acid
CID 123951308
2-(4-methoxy-2,3-dimethylphenyl)propan-1-ol
CID 117284779
(1R)-1-(4-fluoro-2-methoxyphenyl)ethane-1,2-diamine;hydrochloride
CID 171224876
1-(4-fluoro-2-methoxyphenyl)prop-2-en-1-amine
CID 55282422
N-[1-(4-fluoro-2-methoxyphenyl)ethyl]propan-1-amine
CID 63066757

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methoxyphenyl)propan-1-ol?
The IUPAC name of 2-(4-fluoro-2-methoxyphenyl)propan-1-ol (CID 105426240) is 2-(4-fluoro-2-methoxyphenyl)propan-1-ol.
What is the SMILES notation for 2-(4-fluoro-2-methoxyphenyl)propan-1-ol?
The canonical SMILES for 2-(4-fluoro-2-methoxyphenyl)propan-1-ol is COc1cc(F)ccc1C(C)CO.
What is the InChIKey of 2-(4-fluoro-2-methoxyphenyl)propan-1-ol?
The InChIKey is LEDOQFLBKKQRQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO2/c1-7(6-12)9-4-3-8(11)5-10(9)13-2/h3-5,7,12H,6H2,1-2H3.
What are the key properties of 2-(4-fluoro-2-methoxyphenyl)propan-1-ol?
2-(4-fluoro-2-methoxyphenyl)propan-1-ol has a molecular weight of 184.21 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methoxyphenyl)propan-1-ol is sourced from PubChem (CID 105426240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).