[(2R)-4,4-difluorooxolan-2-yl]methanamine

C5H9F2NO — CID 171468237

IUPAC[(2R)-4,4-difluorooxolan-2-yl]methanamine
SMILESNC[C@H]1CC(F)(F)CO1
InChIInChI=1S/C5H9F2NO/c6-5(7)1-4(2-8)9-3-5/h4H,1-3,8H2/t4-/m1/s1
InChIKeyRCJPAVRVGWPQNL-SCSAIBSYSA-N
MW137.13 g/mol
LogP0.37
Rot. Bonds1

About [(2R)-4,4-difluorooxolan-2-yl]methanamine

[(2R)-4,4-difluorooxolan-2-yl]methanamine (PubChem CID 171468237) has the molecular formula C5H9F2NO and a molecular weight of 137.13 g/mol. Its IUPAC name is [(2R)-4,4-difluorooxolan-2-yl]methanamine.

Molecular Properties

Compound Name[(2R)-4,4-difluorooxolan-2-yl]methanamine
PubChem CID171468237
Molecular FormulaC5H9F2NO
Molecular Weight137.13 g/mol
Exact Mass137.07
IUPAC Name[(2R)-4,4-difluorooxolan-2-yl]methanamine
SMILESNC[C@H]1CC(F)(F)CO1
InChIInChI=1S/C5H9F2NO/c6-5(7)1-4(2-8)9-3-5/h4H,1-3,8H2/t4-/m1/s1
InChIKeyRCJPAVRVGWPQNL-SCSAIBSYSA-N
XLogP0.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.13
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2R)-4,4-difluorooxolan-2-yl]methanamine?
The IUPAC name of [(2R)-4,4-difluorooxolan-2-yl]methanamine (CID 171468237) is [(2R)-4,4-difluorooxolan-2-yl]methanamine.
What is the SMILES notation for [(2R)-4,4-difluorooxolan-2-yl]methanamine?
The canonical SMILES for [(2R)-4,4-difluorooxolan-2-yl]methanamine is NC[C@H]1CC(F)(F)CO1.
What is the InChIKey of [(2R)-4,4-difluorooxolan-2-yl]methanamine?
The InChIKey is RCJPAVRVGWPQNL-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H9F2NO/c6-5(7)1-4(2-8)9-3-5/h4H,1-3,8H2/t4-/m1/s1.
What are the key properties of [(2R)-4,4-difluorooxolan-2-yl]methanamine?
[(2R)-4,4-difluorooxolan-2-yl]methanamine has a molecular weight of 137.13 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 [(2R)-4,4-difluorooxolan-2-yl]methanamine is sourced from PubChem (CID 171468237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).