azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine

C10H16F4N4O — CID 175232802

IUPACazane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine
SMILESCCc1nc(CC)nc(OCC(F)(F)C(F)F)n1.N
InChIInChI=1S/C10H13F4N3O.H3N/c1-3-6-15-7(4-2)17-9(16-6)18-5-10(13,14)8(11)12;/h8H,3-5H2,1-2H3;1H3
InChIKeyATJOIOAOPKWMGN-UHFFFAOYSA-N
MW284.26 g/mol
LogP2.44
Rot. Bonds6

About azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine

azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine (PubChem CID 175232802) has the molecular formula C10H16F4N4O and a molecular weight of 284.26 g/mol. Its IUPAC name is azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine.

Molecular Properties

Compound Nameazane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine
PubChem CID175232802
Molecular FormulaC10H16F4N4O
Molecular Weight284.26 g/mol
Exact Mass284.13
IUPAC Nameazane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine
SMILESCCc1nc(CC)nc(OCC(F)(F)C(F)F)n1.N
InChIInChI=1S/C10H13F4N3O.H3N/c1-3-6-15-7(4-2)17-9(16-6)18-5-10(13,14)8(11)12;/h8H,3-5H2,1-2H3;1H3
InChIKeyATJOIOAOPKWMGN-UHFFFAOYSA-N
XLogP2.44
TPSA82.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.26
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine?
The IUPAC name of azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine (CID 175232802) is azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine.
What is the SMILES notation for azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine?
The canonical SMILES for azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine is CCc1nc(CC)nc(OCC(F)(F)C(F)F)n1.N.
What is the InChIKey of azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine?
The InChIKey is ATJOIOAOPKWMGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F4N3O.H3N/c1-3-6-15-7(4-2)17-9(16-6)18-5-10(13,14)8(11)12;/h8H,3-5H2,1-2H3;1H3.
What are the key properties of azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine?
azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine has a molecular weight of 284.26 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2,4-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine is sourced from PubChem (CID 175232802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).