4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine

C7H10F5NO — CID 131093423

IUPAC4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine
SMILESFC(F)[C@H](N1CCOCC1)C(F)(F)F
InChIInChI=1S/C7H10F5NO/c8-6(9)5(7(10,11)12)13-1-3-14-4-2-13/h5-6H,1-4H2/t5-/m0/s1
InChIKeyJVUWLAQJVFWAQE-YFKPBYRVSA-N
MW219.15 g/mol
LogP1.51
Rot. Bonds2

About 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine

4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine (PubChem CID 131093423) has the molecular formula C7H10F5NO and a molecular weight of 219.15 g/mol. Its IUPAC name is 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine.

Molecular Properties

Compound Name4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine
PubChem CID131093423
Molecular FormulaC7H10F5NO
Molecular Weight219.15 g/mol
Exact Mass219.07
IUPAC Name4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine
SMILESFC(F)[C@H](N1CCOCC1)C(F)(F)F
InChIInChI=1S/C7H10F5NO/c8-6(9)5(7(10,11)12)13-1-3-14-4-2-13/h5-6H,1-4H2/t5-/m0/s1
InChIKeyJVUWLAQJVFWAQE-YFKPBYRVSA-N
XLogP1.51
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.15
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine?
The IUPAC name of 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine (CID 131093423) is 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine.
What is the SMILES notation for 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine?
The canonical SMILES for 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine is FC(F)[C@H](N1CCOCC1)C(F)(F)F.
What is the InChIKey of 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine?
The InChIKey is JVUWLAQJVFWAQE-YFKPBYRVSA-N. The full InChI is InChI=1S/C7H10F5NO/c8-6(9)5(7(10,11)12)13-1-3-14-4-2-13/h5-6H,1-4H2/t5-/m0/s1.
What are the key properties of 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine?
4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine has a molecular weight of 219.15 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2S)-1,1,1,3,3-pentafluoropropan-2-yl]morpholine is sourced from PubChem (CID 131093423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).