azane;1,1,1,3,3,3-hexafluoropropane

C3H5F6N — CID 175100137

IUPACazane;1,1,1,3,3,3-hexafluoropropane
SMILESFC(F)(F)CC(F)(F)F.N
InChIInChI=1S/C3H2F6.H3N/c4-2(5,6)1-3(7,8)9;/h1H2;1H3
InChIKeyJMECHSYOKQPYMI-UHFFFAOYSA-N
MW169.07 g/mol
LogP2.66
Rot. Bonds

About azane;1,1,1,3,3,3-hexafluoropropane

azane;1,1,1,3,3,3-hexafluoropropane (PubChem CID 175100137) has the molecular formula C3H5F6N and a molecular weight of 169.07 g/mol. Its IUPAC name is azane;1,1,1,3,3,3-hexafluoropropane.

Molecular Properties

Compound Nameazane;1,1,1,3,3,3-hexafluoropropane
PubChem CID175100137
Molecular FormulaC3H5F6N
Molecular Weight169.07 g/mol
Exact Mass169.03
IUPAC Nameazane;1,1,1,3,3,3-hexafluoropropane
SMILESFC(F)(F)CC(F)(F)F.N
InChIInChI=1S/C3H2F6.H3N/c4-2(5,6)1-3(7,8)9;/h1H2;1H3
InChIKeyJMECHSYOKQPYMI-UHFFFAOYSA-N
XLogP2.66
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.07
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of azane;1,1,1,3,3,3-hexafluoropropane?
The IUPAC name of azane;1,1,1,3,3,3-hexafluoropropane (CID 175100137) is azane;1,1,1,3,3,3-hexafluoropropane.
What is the SMILES notation for azane;1,1,1,3,3,3-hexafluoropropane?
The canonical SMILES for azane;1,1,1,3,3,3-hexafluoropropane is FC(F)(F)CC(F)(F)F.N.
What is the InChIKey of azane;1,1,1,3,3,3-hexafluoropropane?
The InChIKey is JMECHSYOKQPYMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F6.H3N/c4-2(5,6)1-3(7,8)9;/h1H2;1H3.
What are the key properties of azane;1,1,1,3,3,3-hexafluoropropane?
azane;1,1,1,3,3,3-hexafluoropropane has a molecular weight of 169.07 g/mol, XLogP of 2.66, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;1,1,1,3,3,3-hexafluoropropane is sourced from PubChem (CID 175100137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).