3-(3-fluorocyclohexyl)oxyazetidine

C9H16FNO — CID 146300097

IUPAC3-(3-fluorocyclohexyl)oxyazetidine
SMILESFC1CCCC(OC2CNC2)C1
InChIInChI=1S/C9H16FNO/c10-7-2-1-3-8(4-7)12-9-5-11-6-9/h7-9,11H,1-6H2
InChIKeyFSRFYYPDVIEMMK-UHFFFAOYSA-N
MW173.23 g/mol
LogP1.26
Rot. Bonds2

About 3-(3-fluorocyclohexyl)oxyazetidine

3-(3-fluorocyclohexyl)oxyazetidine (PubChem CID 146300097) has the molecular formula C9H16FNO and a molecular weight of 173.23 g/mol. Its IUPAC name is 3-(3-fluorocyclohexyl)oxyazetidine.

Molecular Properties

Compound Name3-(3-fluorocyclohexyl)oxyazetidine
PubChem CID146300097
Molecular FormulaC9H16FNO
Molecular Weight173.23 g/mol
Exact Mass173.12
IUPAC Name3-(3-fluorocyclohexyl)oxyazetidine
SMILESFC1CCCC(OC2CNC2)C1
InChIInChI=1S/C9H16FNO/c10-7-2-1-3-8(4-7)12-9-5-11-6-9/h7-9,11H,1-6H2
InChIKeyFSRFYYPDVIEMMK-UHFFFAOYSA-N
XLogP1.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.23
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(3-fluorocyclohexyl)oxyazetidine?
The IUPAC name of 3-(3-fluorocyclohexyl)oxyazetidine (CID 146300097) is 3-(3-fluorocyclohexyl)oxyazetidine.
What is the SMILES notation for 3-(3-fluorocyclohexyl)oxyazetidine?
The canonical SMILES for 3-(3-fluorocyclohexyl)oxyazetidine is FC1CCCC(OC2CNC2)C1.
What is the InChIKey of 3-(3-fluorocyclohexyl)oxyazetidine?
The InChIKey is FSRFYYPDVIEMMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FNO/c10-7-2-1-3-8(4-7)12-9-5-11-6-9/h7-9,11H,1-6H2.
What are the key properties of 3-(3-fluorocyclohexyl)oxyazetidine?
3-(3-fluorocyclohexyl)oxyazetidine has a molecular weight of 173.23 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluorocyclohexyl)oxyazetidine is sourced from PubChem (CID 146300097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).