5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol

C9H16F3NO2 — CID 91378325

IUPAC5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol
SMILESCC(O)(CCC(F)(F)F)C1CNCCO1
InChIInChI=1S/C9H16F3NO2/c1-8(14,2-3-9(10,11)12)7-6-13-4-5-15-7/h7,13-14H,2-6H2,1H3
InChIKeyOFDWOKGUIINOJM-UHFFFAOYSA-N
MW227.23 g/mol
LogP1.07
Rot. Bonds3

About 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol

5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol (PubChem CID 91378325) has the molecular formula C9H16F3NO2 and a molecular weight of 227.23 g/mol. Its IUPAC name is 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol.

Molecular Properties

Compound Name5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol
PubChem CID91378325
Molecular FormulaC9H16F3NO2
Molecular Weight227.23 g/mol
Exact Mass227.11
IUPAC Name5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol
SMILESCC(O)(CCC(F)(F)F)C1CNCCO1
InChIInChI=1S/C9H16F3NO2/c1-8(14,2-3-9(10,11)12)7-6-13-4-5-15-7/h7,13-14H,2-6H2,1H3
InChIKeyOFDWOKGUIINOJM-UHFFFAOYSA-N
XLogP1.07
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.23
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol?
The IUPAC name of 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol (CID 91378325) is 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol.
What is the SMILES notation for 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol?
The canonical SMILES for 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol is CC(O)(CCC(F)(F)F)C1CNCCO1.
What is the InChIKey of 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol?
The InChIKey is OFDWOKGUIINOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3NO2/c1-8(14,2-3-9(10,11)12)7-6-13-4-5-15-7/h7,13-14H,2-6H2,1H3.
What are the key properties of 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol?
5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol has a molecular weight of 227.23 g/mol, XLogP of 1.07, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,5-trifluoro-2-morpholin-2-ylpentan-2-ol is sourced from PubChem (CID 91378325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).