4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine

C8H11F3N4 — CID 79964530

IUPAC4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine
SMILESCCc1nc(N)nc(CCC(F)(F)F)n1
InChIInChI=1S/C8H11F3N4/c1-2-5-13-6(15-7(12)14-5)3-4-8(9,10)11/h2-4H2,1H3,(H2,12,13,14,15)
InChIKeyNMCPLKQEABFDKM-UHFFFAOYSA-N
MW220.20 g/mol
LogP1.51
Rot. Bonds3

About 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine

4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine (PubChem CID 79964530) has the molecular formula C8H11F3N4 and a molecular weight of 220.20 g/mol. Its IUPAC name is 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine
PubChem CID79964530
Molecular FormulaC8H11F3N4
Molecular Weight220.20 g/mol
Exact Mass220.09
IUPAC Name4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine
SMILESCCc1nc(N)nc(CCC(F)(F)F)n1
InChIInChI=1S/C8H11F3N4/c1-2-5-13-6(15-7(12)14-5)3-4-8(9,10)11/h2-4H2,1H3,(H2,12,13,14,15)
InChIKeyNMCPLKQEABFDKM-UHFFFAOYSA-N
XLogP1.51
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Launch Full Analysis

Related Compounds

s-Triazine, 2-amino-4-methyl-6-(trifluoromethyl)-
CID 168866
6-Ethyl-1,3,5-triazine-2,4-diamine
CID 13628
6-Propyl-1,3,5-triazine-2,4-diamine
CID 22252
6-Pentyl-1,3,5-triazine-2,4-diamine
CID 18673
2,4,6-Triethyltriazine
CID 13889
1,3,5-Triazine-2,4-diamine, 6-butyl-
CID 18602
4-Methyl-6-(propan-2-yl)-1,3,5-triazin-2-amine
CID 45092657
6-(1-Fluoroethyl)-1,3,5-triazine-2,4-diamine
CID 101880615
2-Amino-4,6-bis(heptafluoropropyl)-1,3,5-triazine
CID 15486769
2,4-Bis(1,1,2,2,3,3,3-heptafluoropropyl)-6-methyl-1,3,5-triazine
CID 15877564
6-(1,1,2,2,3,3,3-heptafluoropropyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 178327053
Bis(propan-2-yl)-1,3,5-triazin-2-amine
CID 63869137

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine (CID 79964530) is 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine is CCc1nc(N)nc(CCC(F)(F)F)n1.
What is the InChIKey of 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine?
The InChIKey is NMCPLKQEABFDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N4/c1-2-5-13-6(15-7(12)14-5)3-4-8(9,10)11/h2-4H2,1H3,(H2,12,13,14,15).
What are the key properties of 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine?
4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine has a molecular weight of 220.20 g/mol, XLogP of 1.51, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 79964530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).