4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine

C11H16F5NO2 — CID 130427396

IUPAC4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine
SMILESFC(F)(F)C(N1CCOCC1)C(F)(F)C1CCCO1
InChIInChI=1S/C11H16F5NO2/c12-10(13,8-2-1-5-19-8)9(11(14,15)16)17-3-6-18-7-4-17/h8-9H,1-7H2
InChIKeySZYWOVRCPKAUFH-UHFFFAOYSA-N
MW289.24 g/mol
LogP2.06
Rot. Bonds3

About 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine

4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine (PubChem CID 130427396) has the molecular formula C11H16F5NO2 and a molecular weight of 289.24 g/mol. Its IUPAC name is 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine.

Molecular Properties

Compound Name4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine
PubChem CID130427396
Molecular FormulaC11H16F5NO2
Molecular Weight289.24 g/mol
Exact Mass289.11
IUPAC Name4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine
SMILESFC(F)(F)C(N1CCOCC1)C(F)(F)C1CCCO1
InChIInChI=1S/C11H16F5NO2/c12-10(13,8-2-1-5-19-8)9(11(14,15)16)17-3-6-18-7-4-17/h8-9H,1-7H2
InChIKeySZYWOVRCPKAUFH-UHFFFAOYSA-N
XLogP2.06
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.24
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine?
The IUPAC name of 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine (CID 130427396) is 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine.
What is the SMILES notation for 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine?
The canonical SMILES for 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine is FC(F)(F)C(N1CCOCC1)C(F)(F)C1CCCO1.
What is the InChIKey of 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine?
The InChIKey is SZYWOVRCPKAUFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F5NO2/c12-10(13,8-2-1-5-19-8)9(11(14,15)16)17-3-6-18-7-4-17/h8-9H,1-7H2.
What are the key properties of 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine?
4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine has a molecular weight of 289.24 g/mol, XLogP of 2.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1,1,1,3,3-pentafluoro-3-(oxolan-2-yl)propan-2-yl]morpholine is sourced from PubChem (CID 130427396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).