[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol

C11H13FO — CID 81358099

IUPAC[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol
SMILESCC1(c2cccc(F)c2)CC1CO
InChIInChI=1S/C11H13FO/c1-11(6-9(11)7-13)8-3-2-4-10(12)5-8/h2-5,9,13H,6-7H2,1H3
InChIKeyUCNUMQCWOUNPDY-UHFFFAOYSA-N
MW180.22 g/mol
LogP2.10
Rot. Bonds2

About [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol

[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol (PubChem CID 81358099) has the molecular formula C11H13FO and a molecular weight of 180.22 g/mol. Its IUPAC name is [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol.

Molecular Properties

Compound Name[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol
PubChem CID81358099
Molecular FormulaC11H13FO
Molecular Weight180.22 g/mol
Exact Mass180.10
IUPAC Name[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol
SMILESCC1(c2cccc(F)c2)CC1CO
InChIInChI=1S/C11H13FO/c1-11(6-9(11)7-13)8-3-2-4-10(12)5-8/h2-5,9,13H,6-7H2,1H3
InChIKeyUCNUMQCWOUNPDY-UHFFFAOYSA-N
XLogP2.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.22
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol?
The IUPAC name of [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol (CID 81358099) is [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol.
What is the SMILES notation for [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol?
The canonical SMILES for [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol is CC1(c2cccc(F)c2)CC1CO.
What is the InChIKey of [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol?
The InChIKey is UCNUMQCWOUNPDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FO/c1-11(6-9(11)7-13)8-3-2-4-10(12)5-8/h2-5,9,13H,6-7H2,1H3.
What are the key properties of [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol?
[2-(3-fluorophenyl)-2-methylcyclopropyl]methanol has a molecular weight of 180.22 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-fluorophenyl)-2-methylcyclopropyl]methanol is sourced from PubChem (CID 81358099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).