(2S)-2-(4-fluorophenyl)-2-methyloxetane

C10H11FO — CID 102038097

IUPAC(2S)-2-(4-fluorophenyl)-2-methyloxetane
SMILESC[C@@]1(c2ccc(F)cc2)CCO1
InChIInChI=1S/C10H11FO/c1-10(6-7-12-10)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3/t10-/m0/s1
InChIKeyLQXJZQFWNPDNTP-JTQLQIEISA-N
MW166.19 g/mol
LogP2.46
Rot. Bonds1

About (2S)-2-(4-fluorophenyl)-2-methyloxetane

(2S)-2-(4-fluorophenyl)-2-methyloxetane (PubChem CID 102038097) has the molecular formula C10H11FO and a molecular weight of 166.19 g/mol. Its IUPAC name is (2S)-2-(4-fluorophenyl)-2-methyloxetane.

Molecular Properties

Compound Name(2S)-2-(4-fluorophenyl)-2-methyloxetane
PubChem CID102038097
Molecular FormulaC10H11FO
Molecular Weight166.19 g/mol
Exact Mass166.08
IUPAC Name(2S)-2-(4-fluorophenyl)-2-methyloxetane
SMILESC[C@@]1(c2ccc(F)cc2)CCO1
InChIInChI=1S/C10H11FO/c1-10(6-7-12-10)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3/t10-/m0/s1
InChIKeyLQXJZQFWNPDNTP-JTQLQIEISA-N
XLogP2.46
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.19
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-fluorophenyl)-2-methyloxetane?
The IUPAC name of (2S)-2-(4-fluorophenyl)-2-methyloxetane (CID 102038097) is (2S)-2-(4-fluorophenyl)-2-methyloxetane.
What is the SMILES notation for (2S)-2-(4-fluorophenyl)-2-methyloxetane?
The canonical SMILES for (2S)-2-(4-fluorophenyl)-2-methyloxetane is C[C@@]1(c2ccc(F)cc2)CCO1.
What is the InChIKey of (2S)-2-(4-fluorophenyl)-2-methyloxetane?
The InChIKey is LQXJZQFWNPDNTP-JTQLQIEISA-N. The full InChI is InChI=1S/C10H11FO/c1-10(6-7-12-10)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3/t10-/m0/s1.
What are the key properties of (2S)-2-(4-fluorophenyl)-2-methyloxetane?
(2S)-2-(4-fluorophenyl)-2-methyloxetane has a molecular weight of 166.19 g/mol, XLogP of 2.46, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-fluorophenyl)-2-methyloxetane is sourced from PubChem (CID 102038097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).