1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol

C11H13FO2 — CID 79333022

IUPAC1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol
SMILESCOc1cccc(F)c1C1(O)CC1C
InChIInChI=1S/C11H13FO2/c1-7-6-11(7,13)10-8(12)4-3-5-9(10)14-2/h3-5,7,13H,6H2,1-2H3
InChIKeyPZXCEEAGXFZRKW-UHFFFAOYSA-N
MW196.22 g/mol
LogP2.06
Rot. Bonds2

About 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol

1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol (PubChem CID 79333022) has the molecular formula C11H13FO2 and a molecular weight of 196.22 g/mol. Its IUPAC name is 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol.

Molecular Properties

Compound Name1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol
PubChem CID79333022
Molecular FormulaC11H13FO2
Molecular Weight196.22 g/mol
Exact Mass196.09
IUPAC Name1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol
SMILESCOc1cccc(F)c1C1(O)CC1C
InChIInChI=1S/C11H13FO2/c1-7-6-11(7,13)10-8(12)4-3-5-9(10)14-2/h3-5,7,13H,6H2,1-2H3
InChIKeyPZXCEEAGXFZRKW-UHFFFAOYSA-N
XLogP2.06
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.22
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol?
The IUPAC name of 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol (CID 79333022) is 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol.
What is the SMILES notation for 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol?
The canonical SMILES for 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol is COc1cccc(F)c1C1(O)CC1C.
What is the InChIKey of 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol?
The InChIKey is PZXCEEAGXFZRKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO2/c1-7-6-11(7,13)10-8(12)4-3-5-9(10)14-2/h3-5,7,13H,6H2,1-2H3.
What are the key properties of 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol?
1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol has a molecular weight of 196.22 g/mol, XLogP of 2.06, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-6-methoxyphenyl)-2-methylcyclopropan-1-ol is sourced from PubChem (CID 79333022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).