4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine

C7H6F6N4O2 — CID 1375552

IUPAC4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
SMILESNc1nc(OCC(F)(F)F)nc(OCC(F)(F)F)n1
InChIInChI=1S/C7H6F6N4O2/c8-6(9,10)1-18-4-15-3(14)16-5(17-4)19-2-7(11,12)13/h1-2H2,(H2,14,15,16,17)
InChIKeyBLRWOTDMVWVIHW-UHFFFAOYSA-N
MW292.14 g/mol
LogP1.34
Rot. Bonds4

About 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine

4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine (PubChem CID 1375552) has the molecular formula C7H6F6N4O2 and a molecular weight of 292.14 g/mol. Its IUPAC name is 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
PubChem CID1375552
Molecular FormulaC7H6F6N4O2
Molecular Weight292.14 g/mol
Exact Mass292.04
IUPAC Name4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
SMILESNc1nc(OCC(F)(F)F)nc(OCC(F)(F)F)n1
InChIInChI=1S/C7H6F6N4O2/c8-6(9,10)1-18-4-15-3(14)16-5(17-4)19-2-7(11,12)13/h1-2H2,(H2,14,15,16,17)
InChIKeyBLRWOTDMVWVIHW-UHFFFAOYSA-N
XLogP1.34
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.14
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1,3,5-Triazine-2,4-diamine, N2,N2-dimethyl-6-(2,2,2-trifluoroethoxy)-
CID 10933513
6-(2,2,2-Trifluoroethoxy)-1,3,5-triazine-2,4-diamine
CID 139595246
4,6-Bis[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-1,3,5-triazin-2-amine
CID 550572
2,4,6-Tris(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 3091708
N-methyl-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 1375553
2-Chloro-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 53342808
N-[4,6-Bis-(2,2,2-trifluoro-1-trifluoromethylethoxy)-[1,3,5]triazin-2-yl]hydroxylamine
CID 5086209
2,4,6-Tris(2,2,3,3,3-pentafluoropropoxy)-1,3,5-triazine
CID 12586979
1,3,5-Triazin-2-amine, 4-methoxy-6-(2,2,2-trifluoroethoxy)-
CID 180958
2-Amino-4-methoxy-6-trifluoromethoxy-1,3,5-triazine
CID 15010393
2-Amino-4-ethoxy-6-trifluoromethoxy-1,3,5-triazine
CID 15010395
4-[Chloro(difluoro)methoxy]-6-ethoxy-1,3,5-triazin-2-amine
CID 15010396

Frequently Asked Questions

What is the IUPAC name of 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine (CID 1375552) is 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine is Nc1nc(OCC(F)(F)F)nc(OCC(F)(F)F)n1.
What is the InChIKey of 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The InChIKey is BLRWOTDMVWVIHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F6N4O2/c8-6(9,10)1-18-4-15-3(14)16-5(17-4)19-2-7(11,12)13/h1-2H2,(H2,14,15,16,17).
What are the key properties of 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine has a molecular weight of 292.14 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 1375552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).