3-(fluoromethyl)morpholine;hydrochloride

C5H11ClFNO — CID 22342647

IUPAC3-(fluoromethyl)morpholine;hydrochloride
SMILESCl.FCC1COCCN1
InChIInChI=1S/C5H10FNO.ClH/c6-3-5-4-8-2-1-7-5;/h5,7H,1-4H2;1H
InChIKeyCKPCDQGUDWJMNH-UHFFFAOYSA-N
MW155.60 g/mol
LogP0.37
Rot. Bonds1

About 3-(fluoromethyl)morpholine;hydrochloride

3-(fluoromethyl)morpholine;hydrochloride (PubChem CID 22342647) has the molecular formula C5H11ClFNO and a molecular weight of 155.60 g/mol. Its IUPAC name is 3-(fluoromethyl)morpholine;hydrochloride.

Molecular Properties

Compound Name3-(fluoromethyl)morpholine;hydrochloride
PubChem CID22342647
Molecular FormulaC5H11ClFNO
Molecular Weight155.60 g/mol
Exact Mass155.05
IUPAC Name3-(fluoromethyl)morpholine;hydrochloride
SMILESCl.FCC1COCCN1
InChIInChI=1S/C5H10FNO.ClH/c6-3-5-4-8-2-1-7-5;/h5,7H,1-4H2;1H
InChIKeyCKPCDQGUDWJMNH-UHFFFAOYSA-N
XLogP0.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.60
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(fluoromethyl)morpholine;hydrochloride?
The IUPAC name of 3-(fluoromethyl)morpholine;hydrochloride (CID 22342647) is 3-(fluoromethyl)morpholine;hydrochloride.
What is the SMILES notation for 3-(fluoromethyl)morpholine;hydrochloride?
The canonical SMILES for 3-(fluoromethyl)morpholine;hydrochloride is Cl.FCC1COCCN1.
What is the InChIKey of 3-(fluoromethyl)morpholine;hydrochloride?
The InChIKey is CKPCDQGUDWJMNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO.ClH/c6-3-5-4-8-2-1-7-5;/h5,7H,1-4H2;1H.
What are the key properties of 3-(fluoromethyl)morpholine;hydrochloride?
3-(fluoromethyl)morpholine;hydrochloride has a molecular weight of 155.60 g/mol, XLogP of 0.37, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(fluoromethyl)morpholine;hydrochloride is sourced from PubChem (CID 22342647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).