2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine

C7H10F3N5 — CID 139724206

IUPAC2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(CC(F)(F)F)nc(NC)n1
InChIInChI=1S/C7H10F3N5/c1-11-5-13-4(3-7(8,9)10)14-6(12-2)15-5/h3H2,1-2H3,(H2,11,12,13,14,15)
InChIKeySEJALQBHGQDEPP-UHFFFAOYSA-N
MW221.19 g/mol
LogP1.06
Rot. Bonds3

About 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine

2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 139724206) has the molecular formula C7H10F3N5 and a molecular weight of 221.19 g/mol. Its IUPAC name is 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine
PubChem CID139724206
Molecular FormulaC7H10F3N5
Molecular Weight221.19 g/mol
Exact Mass221.09
IUPAC Name2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(CC(F)(F)F)nc(NC)n1
InChIInChI=1S/C7H10F3N5/c1-11-5-13-4(3-7(8,9)10)14-6(12-2)15-5/h3H2,1-2H3,(H2,11,12,13,14,15)
InChIKeySEJALQBHGQDEPP-UHFFFAOYSA-N
XLogP1.06
TPSA62.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.19
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

1,3,5-Triazine-2,4-diamine, N,N'-diethyl-6-(trifluoromethyl)-
CID 12871
4-Ethyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 199901
6-Ethyl-1,3,5-triazine-2,4-diamine
CID 13628
s-Triazine, 2-methyl-4-methylamino-6-(trifluoromethyl)-
CID 3041947
s-Triazine, 2-dimethylamino-4-isopropylamino-6-(trifluoromethyl)-
CID 3041954
s-Triazine, 2-isopropylamino-4-methylamino-6-trifluoromethyl-
CID 3041963
N~2~-(Butan-2-yl)-6-(trifluoromethyl)-1,3,5-triazine-2,4(1H,3H)-diimine
CID 3041965
1,3,5-Triazin-2-amine, N-ethyl-4-methyl-6-(trifluoromethyl)-
CID 3041968
s-Triazine, 2-amino-4-isopropylamino-6-trifluoromethyl-
CID 3041987
6-(1-Fluoroethyl)-1,3,5-triazine-2,4-diamine
CID 101880615
N,4,6-Trimethyl-1,3,5-triazin-2-amine
CID 20658992
N~2~,N~4~,6-Trimethyl-1,3,5-triazine-2,4-diamine
CID 16085

Frequently Asked Questions

What is the IUPAC name of 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine (CID 139724206) is 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine is CNc1nc(CC(F)(F)F)nc(NC)n1.
What is the InChIKey of 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is SEJALQBHGQDEPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F3N5/c1-11-5-13-4(3-7(8,9)10)14-6(12-2)15-5/h3H2,1-2H3,(H2,11,12,13,14,15).
What are the key properties of 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine?
2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 221.19 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N-dimethyl-6-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 139724206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).