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

C8H11F3N4O — CID 20652999

IUPACN,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
SMILESCc1nc(OCC(F)(F)F)nc(N(C)C)n1
InChIInChI=1S/C8H11F3N4O/c1-5-12-6(15(2)3)14-7(13-5)16-4-8(9,10)11/h4H2,1-3H3
InChIKeySKTUYVZYOFNVHH-UHFFFAOYSA-N
MW236.20 g/mol
LogP1.19
Rot. Bonds3

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

N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine (PubChem CID 20652999) has the molecular formula C8H11F3N4O and a molecular weight of 236.20 g/mol. Its IUPAC name is N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
PubChem CID20652999
Molecular FormulaC8H11F3N4O
Molecular Weight236.20 g/mol
Exact Mass236.09
IUPAC NameN,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
SMILESCc1nc(OCC(F)(F)F)nc(N(C)C)n1
InChIInChI=1S/C8H11F3N4O/c1-5-12-6(15(2)3)14-7(13-5)16-4-8(9,10)11/h4H2,1-3H3
InChIKeySKTUYVZYOFNVHH-UHFFFAOYSA-N
XLogP1.19
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.20
LogP ≤ 51.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1,3,5-Triazin-2-amine, 4-ethoxy-6-(trifluoromethyl)-
CID 199947
1,3,5-Triazine, 2-methyl-4-(4-morpholinyl)-6-(trifluoromethyl)-
CID 3041949
6-(difluoromethyl)-2-N-ethyl-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine
CID 132395027
1,3,5-Triazin-2-amine, 4-propoxy-6-(trifluoromethyl)-
CID 10900193
2-Chloro-4-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 20702269
4-(2,2-difluoroethoxy)-N,N,6-trimethyl-1,3,5-triazin-2-amine
CID 20713449
2-Ethoxy-4-(trifluoromethyl)-1,3,5-triazine
CID 70367298
N-(2-ethoxyethyl)-4-fluoro-N,6-dimethyl-1,3,5-triazin-2-amine
CID 70870519
N,4-diethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 123308053
2-Chloro-1,4-dimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-1-ium
CID 123624110
N-ethyl-4-methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 123689010
4-Methyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 141834652

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The IUPAC name of N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine (CID 20652999) is N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The canonical SMILES for N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine is Cc1nc(OCC(F)(F)F)nc(N(C)C)n1.
What is the InChIKey of N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
The InChIKey is SKTUYVZYOFNVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N4O/c1-5-12-6(15(2)3)14-7(13-5)16-4-8(9,10)11/h4H2,1-3H3.
What are the key properties of N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine?
N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine has a molecular weight of 236.20 g/mol, XLogP of 1.19, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 20652999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).