[1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol

C11H14FNO — CID 71757211

IUPAC[1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol
SMILESCC1(CO)CN(c2ccc(F)cc2)C1
InChIInChI=1S/C11H14FNO/c1-11(8-14)6-13(7-11)10-4-2-9(12)3-5-10/h2-5,14H,6-8H2,1H3
InChIKeyDMHBZKHOJFIBCO-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.64
Rot. Bonds2

About [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol

[1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol (PubChem CID 71757211) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol.

Molecular Properties

Compound Name[1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol
PubChem CID71757211
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name[1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol
SMILESCC1(CO)CN(c2ccc(F)cc2)C1
InChIInChI=1S/C11H14FNO/c1-11(8-14)6-13(7-11)10-4-2-9(12)3-5-10/h2-5,14H,6-8H2,1H3
InChIKeyDMHBZKHOJFIBCO-UHFFFAOYSA-N
XLogP1.64
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol?
The IUPAC name of [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol (CID 71757211) is [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol.
What is the SMILES notation for [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol?
The canonical SMILES for [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol is CC1(CO)CN(c2ccc(F)cc2)C1.
What is the InChIKey of [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol?
The InChIKey is DMHBZKHOJFIBCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-11(8-14)6-13(7-11)10-4-2-9(12)3-5-10/h2-5,14H,6-8H2,1H3.
What are the key properties of [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol?
[1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol has a molecular weight of 195.24 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-fluorophenyl)-3-methylazetidin-3-yl]methanol is sourced from PubChem (CID 71757211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).