5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol

C10H11FO3 — CID 117287688

IUPAC5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol
SMILESCOc1cc(F)cc(O)c1C1(O)CC1
InChIInChI=1S/C10H11FO3/c1-14-8-5-6(11)4-7(12)9(8)10(13)2-3-10/h4-5,12-13H,2-3H2,1H3
InChIKeyMSSUELBYAKOCET-UHFFFAOYSA-N
MW198.19 g/mol
LogP1.52
Rot. Bonds2

About 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol

5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol (PubChem CID 117287688) has the molecular formula C10H11FO3 and a molecular weight of 198.19 g/mol. Its IUPAC name is 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol.

Molecular Properties

Compound Name5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol
PubChem CID117287688
Molecular FormulaC10H11FO3
Molecular Weight198.19 g/mol
Exact Mass198.07
IUPAC Name5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol
SMILESCOc1cc(F)cc(O)c1C1(O)CC1
InChIInChI=1S/C10H11FO3/c1-14-8-5-6(11)4-7(12)9(8)10(13)2-3-10/h4-5,12-13H,2-3H2,1H3
InChIKeyMSSUELBYAKOCET-UHFFFAOYSA-N
XLogP1.52
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.19
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(1-hydroxycyclopropyl)-3-methoxy-5-(trifluoromethyl)phenol
CID 84803554
4-chloro-3-fluoro-2-(1-hydroxycyclopropyl)-5-methoxyphenol
CID 84795728
1-(4-fluoro-2-hydroxy-6-methoxyphenyl)cyclohexane-1-carboxylic acid
CID 117424298
3-chloro-2-(1-hydroxycyclopropyl)-4,5-dimethoxyphenol
CID 117363639
5-fluoro-2-(1-hydroxycyclopropyl)-4-methoxyphenol
CID 117287689
1-(2-fluoro-6-methoxyphenyl)cyclopropan-1-ol
CID 65434652
4-fluoro-2-[(1-hydroxycyclopropyl)methyl]-6-methoxyphenol
CID 117302776
2-chloro-3-(1-hydroxycyclopropyl)-4,5-dimethoxyphenol
CID 117363638
1-(3-fluoro-2,6-dimethoxyphenyl)cyclopropan-1-ol
CID 117302785
1-(2-fluoro-3-methoxyphenyl)cyclopropan-1-ol
CID 83808255
1-(2,6-difluoro-3-methoxyphenyl)cyclopropan-1-ol
CID 84775707
1-(4-bromo-5-fluoro-2-methoxyphenyl)cyclopropan-1-ol
CID 84806667

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol?
The IUPAC name of 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol (CID 117287688) is 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol.
What is the SMILES notation for 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol?
The canonical SMILES for 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol is COc1cc(F)cc(O)c1C1(O)CC1.
What is the InChIKey of 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol?
The InChIKey is MSSUELBYAKOCET-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO3/c1-14-8-5-6(11)4-7(12)9(8)10(13)2-3-10/h4-5,12-13H,2-3H2,1H3.
What are the key properties of 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol?
5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol has a molecular weight of 198.19 g/mol, XLogP of 1.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(1-hydroxycyclopropyl)-3-methoxyphenol is sourced from PubChem (CID 117287688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).