(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol

C10H13FO2 — CID 79002413

IUPAC(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
SMILESCC[C@@H](O)c1cc(F)ccc1OC
InChIInChI=1S/C10H13FO2/c1-3-9(12)8-6-7(11)4-5-10(8)13-2/h4-6,9,12H,3H2,1-2H3/t9-/m1/s1
InChIKeyAAAIULAUADTJJG-SECBINFHSA-N
MW184.21 g/mol
LogP2.28
Rot. Bonds3

About (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol

(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol (PubChem CID 79002413) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol.

Molecular Properties

Compound Name(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
PubChem CID79002413
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
SMILESCC[C@@H](O)c1cc(F)ccc1OC
InChIInChI=1S/C10H13FO2/c1-3-9(12)8-6-7(11)4-5-10(8)13-2/h4-6,9,12H,3H2,1-2H3/t9-/m1/s1
InChIKeyAAAIULAUADTJJG-SECBINFHSA-N
XLogP2.28
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 ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,3,3-trifluoro-1-(5-fluoro-2-methoxyphenyl)propan-1-ol
CID 61087261
1-(5-fluoro-2-methoxyphenyl)-3-methoxy-3-methylbutan-1-ol
CID 103027670
(1R)-1-(5-fluoro-2-methoxyphenyl)ethanol
CID 26597266
(1S,2R)-1-amino-1-(5-fluoro-2-methoxyphenyl)-3-methylpentan-2-ol;hydrochloride
CID 171268211
(1R)-1-(5-fluoro-2-methoxyphenyl)-2-[methyl(propan-2-yl)amino]ethanol
CID 142421091
1-(5-fluoro-2-methoxyphenyl)-4-methoxy-3-methylbutan-1-ol
CID 105122379
1-(5-ethoxy-2-methoxyphenyl)propan-1-ol
CID 82265613
3-(5-fluoro-2-methoxyphenyl)butan-2-ol
CID 82781916
2-(5-fluoro-2-methoxyphenyl)propane-1,3-diol
CID 82112362
3-bromo-1-(5-fluoro-2-methoxyphenyl)propane-1,2-diol
CID 171859876
1-(5-fluoro-2-methoxyphenyl)butane-1,2-diamine
CID 165347841
4-fluoro-2-(1-hydroxypropyl)phenol
CID 82268240

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol?
The IUPAC name of (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol (CID 79002413) is (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol.
What is the SMILES notation for (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol?
The canonical SMILES for (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol is CC[C@@H](O)c1cc(F)ccc1OC.
What is the InChIKey of (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol?
The InChIKey is AAAIULAUADTJJG-SECBINFHSA-N. The full InChI is InChI=1S/C10H13FO2/c1-3-9(12)8-6-7(11)4-5-10(8)13-2/h4-6,9,12H,3H2,1-2H3/t9-/m1/s1.
What are the key properties of (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol?
(1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol has a molecular weight of 184.21 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(5-fluoro-2-methoxyphenyl)propan-1-ol is sourced from PubChem (CID 79002413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).