2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine

C10H15F4N5O — CID 80868128

IUPAC2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(N)nc(OCC(F)(F)C(F)F)n1
InChIInChI=1S/C10H15F4N5O/c1-3-19(4-2)8-16-7(15)17-9(18-8)20-5-10(13,14)6(11)12/h6H,3-5H2,1-2H3,(H2,15,16,17,18)
InChIKeySGCVREUUSYYABH-UHFFFAOYSA-N
MW297.26 g/mol
LogP1.58
Rot. Bonds7

About 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine

2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine (PubChem CID 80868128) has the molecular formula C10H15F4N5O and a molecular weight of 297.26 g/mol. Its IUPAC name is 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine
PubChem CID80868128
Molecular FormulaC10H15F4N5O
Molecular Weight297.26 g/mol
Exact Mass297.12
IUPAC Name2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(N)nc(OCC(F)(F)C(F)F)n1
InChIInChI=1S/C10H15F4N5O/c1-3-19(4-2)8-16-7(15)17-9(18-8)20-5-10(13,14)6(11)12/h6H,3-5H2,1-2H3,(H2,15,16,17,18)
InChIKeySGCVREUUSYYABH-UHFFFAOYSA-N
XLogP1.58
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.26
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1,3,5-Triazine-2,4-diamine, N2,N2-dimethyl-6-(2,2,2-trifluoroethoxy)-
CID 10933513
1,3,5-Triazine, 4,6-bis(2,2,2-trifluoro-1-trifluoromethylethoxy)-2-propylamino-
CID 550627
N-propyl-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 2267441
N-(sec-butyl)-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 3241353
N~2~-(sec-butyl)-N~4~,N~4~-diethyl-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-1,3,5-triazine-2,4-diamine
CID 3094636
N-Ethyl-4,6-bis[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-1,3,5-triazin-2-amine
CID 549848
4-N-butyl-6-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-2-N,2-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 126478020
[4,6-Bis-(2,2,2-trifluoro-ethoxy)-[1,3,5]triazin-2-yl]-butyl-amine
CID 627767
2-N,2-N-diethyl-6-methoxy-4-N-methyl-4-N-(2,2,2-trifluoroethyl)-1,3,5-triazine-2,4-diamine
CID 20453896
2-N,2-N-dimethyl-6-(1,2,2,2-tetrafluoroethoxy)-1,3,5-triazine-2,4-diamine
CID 53960150
4-chloro-N,N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine
CID 62870480
2-N,2-N-diethyl-4-N-methyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine
CID 80843053

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine (CID 80868128) is 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine is CCN(CC)c1nc(N)nc(OCC(F)(F)C(F)F)n1.
What is the InChIKey of 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine?
The InChIKey is SGCVREUUSYYABH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F4N5O/c1-3-19(4-2)8-16-7(15)17-9(18-8)20-5-10(13,14)6(11)12/h6H,3-5H2,1-2H3,(H2,15,16,17,18).
What are the key properties of 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine?
2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine has a molecular weight of 297.26 g/mol, XLogP of 1.58, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80868128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).