3-fluoro-4-morpholin-4-ylphenol

C10H12FNO2 — CID 46737207

IUPAC3-fluoro-4-morpholin-4-ylphenol
SMILESOc1ccc(N2CCOCC2)c(F)c1
InChIInChI=1S/C10H12FNO2/c11-9-7-8(13)1-2-10(9)12-3-5-14-6-4-12/h1-2,7,13H,3-6H2
InChIKeyBQDJCLPMYXDTSY-UHFFFAOYSA-N
MW197.21 g/mol
LogP1.37
Rot. Bonds1

About 3-fluoro-4-morpholin-4-ylphenol

3-fluoro-4-morpholin-4-ylphenol (PubChem CID 46737207) has the molecular formula C10H12FNO2 and a molecular weight of 197.21 g/mol. Its IUPAC name is 3-fluoro-4-morpholin-4-ylphenol.

Molecular Properties

Compound Name3-fluoro-4-morpholin-4-ylphenol
PubChem CID46737207
Molecular FormulaC10H12FNO2
Molecular Weight197.21 g/mol
Exact Mass197.09
IUPAC Name3-fluoro-4-morpholin-4-ylphenol
SMILESOc1ccc(N2CCOCC2)c(F)c1
InChIInChI=1S/C10H12FNO2/c11-9-7-8(13)1-2-10(9)12-3-5-14-6-4-12/h1-2,7,13H,3-6H2
InChIKeyBQDJCLPMYXDTSY-UHFFFAOYSA-N
XLogP1.37
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-fluoro-4-morpholin-4-ylphenol?
The IUPAC name of 3-fluoro-4-morpholin-4-ylphenol (CID 46737207) is 3-fluoro-4-morpholin-4-ylphenol.
What is the SMILES notation for 3-fluoro-4-morpholin-4-ylphenol?
The canonical SMILES for 3-fluoro-4-morpholin-4-ylphenol is Oc1ccc(N2CCOCC2)c(F)c1.
What is the InChIKey of 3-fluoro-4-morpholin-4-ylphenol?
The InChIKey is BQDJCLPMYXDTSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2/c11-9-7-8(13)1-2-10(9)12-3-5-14-6-4-12/h1-2,7,13H,3-6H2.
What are the key properties of 3-fluoro-4-morpholin-4-ylphenol?
3-fluoro-4-morpholin-4-ylphenol has a molecular weight of 197.21 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-4-morpholin-4-ylphenol is sourced from PubChem (CID 46737207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).