4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine

C8H11F3N4O2 — CID 117062099

IUPAC4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
SMILESCOc1nc(OCC(F)(F)F)nc(N(C)C)n1
InChIInChI=1S/C8H11F3N4O2/c1-15(2)5-12-6(16-3)14-7(13-5)17-4-8(9,10)11/h4H2,1-3H3
InChIKeyHDEPLGDPSDOHCT-UHFFFAOYSA-N
MW252.20 g/mol
LogP0.89
Rot. Bonds4

About 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine

4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine (PubChem CID 117062099) has the molecular formula C8H11F3N4O2 and a molecular weight of 252.20 g/mol. Its IUPAC name is 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
PubChem CID117062099
Molecular FormulaC8H11F3N4O2
Molecular Weight252.20 g/mol
Exact Mass252.08
IUPAC Name4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
SMILESCOc1nc(OCC(F)(F)F)nc(N(C)C)n1
InChIInChI=1S/C8H11F3N4O2/c1-15(2)5-12-6(16-3)14-7(13-5)17-4-8(9,10)11/h4H2,1-3H3
InChIKeyHDEPLGDPSDOHCT-UHFFFAOYSA-N
XLogP0.89
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.20
LogP ≤ 50.89
H-Bond Donors ≤ 50
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
Stk076603
CID 1375559
{[4-(Dimethylamino)-6-methoxy-1,3,5-triazin-2-yl]oxy}acetonitrile
CID 4208960
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
1,3,5-Triazin-2-amine, 4-methoxy-6-(2,2,2-trifluoroethoxy)-
CID 180958
2-Amino-4-ethoxy-6-trifluoromethoxy-1,3,5-triazine
CID 15010395
4-[chloro(difluoro)methoxy]-6-ethoxy-N-methyl-1,3,5-triazin-2-amine
CID 19777640
4-ethoxy-N-methyl-6-(trifluoromethoxy)-1,3,5-triazin-2-amine
CID 19777647
2-N-methyl-6-(1,2,2-trifluoroethoxy)-1,3,5-triazine-2,4-diamine
CID 19870950
N-[4-(Dimethylamino)-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine-2-yl]urea
CID 23039279
N,N-dimethyl-4-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 53816129

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine (CID 117062099) is 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine is COc1nc(OCC(F)(F)F)nc(N(C)C)n1.
What is the InChIKey of 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The InChIKey is HDEPLGDPSDOHCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N4O2/c1-15(2)5-12-6(16-3)14-7(13-5)17-4-8(9,10)11/h4H2,1-3H3.
What are the key properties of 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine has a molecular weight of 252.20 g/mol, XLogP of 0.89, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,N-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 117062099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).