[4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine

C8H13F2N5O2 — CID 82010438

IUPAC[4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
SMILESCC(C)Oc1nc(NN)nc(OCC(F)F)n1
InChIInChI=1S/C8H13F2N5O2/c1-4(2)17-8-13-6(15-11)12-7(14-8)16-3-5(9)10/h4-5H,3,11H2,1-2H3,(H,12,13,14,15)
InChIKeyOJGIFDGCVVBBJN-UHFFFAOYSA-N
MW249.22 g/mol
LogP0.59
Rot. Bonds6

About [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine

[4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine (PubChem CID 82010438) has the molecular formula C8H13F2N5O2 and a molecular weight of 249.22 g/mol. Its IUPAC name is [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
PubChem CID82010438
Molecular FormulaC8H13F2N5O2
Molecular Weight249.22 g/mol
Exact Mass249.10
IUPAC Name[4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
SMILESCC(C)Oc1nc(NN)nc(OCC(F)F)n1
InChIInChI=1S/C8H13F2N5O2/c1-4(2)17-8-13-6(15-11)12-7(14-8)16-3-5(9)10/h4-5H,3,11H2,1-2H3,(H,12,13,14,15)
InChIKeyOJGIFDGCVVBBJN-UHFFFAOYSA-N
XLogP0.59
TPSA95.18 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.22
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine (CID 82010438) is [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine is CC(C)Oc1nc(NN)nc(OCC(F)F)n1.
What is the InChIKey of [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is OJGIFDGCVVBBJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13F2N5O2/c1-4(2)17-8-13-6(15-11)12-7(14-8)16-3-5(9)10/h4-5H,3,11H2,1-2H3,(H,12,13,14,15).
What are the key properties of [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine?
[4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 249.22 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2,2-difluoroethoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 82010438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).