N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine

C6H4F6N4O — CID 19006220

IUPACN-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine
SMILESCNc1nc(OC(F)(F)F)nc(C(F)(F)F)n1
InChIInChI=1S/C6H4F6N4O/c1-13-3-14-2(5(7,8)9)15-4(16-3)17-6(10,11)12/h1H3,(H,13,14,15,16)
InChIKeyUQEKITYLNLIAIM-UHFFFAOYSA-N
MW262.11 g/mol
LogP1.83
Rot. Bonds2

About N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine

N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine (PubChem CID 19006220) has the molecular formula C6H4F6N4O and a molecular weight of 262.11 g/mol. Its IUPAC name is N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine
PubChem CID19006220
Molecular FormulaC6H4F6N4O
Molecular Weight262.11 g/mol
Exact Mass262.03
IUPAC NameN-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine
SMILESCNc1nc(OC(F)(F)F)nc(C(F)(F)F)n1
InChIInChI=1S/C6H4F6N4O/c1-13-3-14-2(5(7,8)9)15-4(16-3)17-6(10,11)12/h1H3,(H,13,14,15,16)
InChIKeyUQEKITYLNLIAIM-UHFFFAOYSA-N
XLogP1.83
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.11
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine?
The IUPAC name of N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine (CID 19006220) is N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine is CNc1nc(OC(F)(F)F)nc(C(F)(F)F)n1.
What is the InChIKey of N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine?
The InChIKey is UQEKITYLNLIAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F6N4O/c1-13-3-14-2(5(7,8)9)15-4(16-3)17-6(10,11)12/h1H3,(H,13,14,15,16).
What are the key properties of N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine?
N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine has a molecular weight of 262.11 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-(trifluoromethoxy)-6-(trifluoromethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 19006220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).