N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine

C10H14F4N4O — CID 175232801

IUPACN,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine
SMILESCCN(CC)c1ncnc(OCC(F)(F)C(F)F)n1
InChIInChI=1S/C10H14F4N4O/c1-3-18(4-2)8-15-6-16-9(17-8)19-5-10(13,14)7(11)12/h6-7H,3-5H2,1-2H3
InChIKeyLZRGWKJRCKUNEW-UHFFFAOYSA-N
MW282.24 g/mol
LogP2.00
Rot. Bonds7

About N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine

N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine (PubChem CID 175232801) has the molecular formula C10H14F4N4O and a molecular weight of 282.24 g/mol. Its IUPAC name is N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine
PubChem CID175232801
Molecular FormulaC10H14F4N4O
Molecular Weight282.24 g/mol
Exact Mass282.11
IUPAC NameN,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine
SMILESCCN(CC)c1ncnc(OCC(F)(F)C(F)F)n1
InChIInChI=1S/C10H14F4N4O/c1-3-18(4-2)8-15-6-16-9(17-8)19-5-10(13,14)7(11)12/h6-7H,3-5H2,1-2H3
InChIKeyLZRGWKJRCKUNEW-UHFFFAOYSA-N
XLogP2.00
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.24
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-N,4-N-diethyl-2-N-phenyl-6-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazine-2,4-diamine
CID 129285934
2-N,2-N-diethyl-4-N-(3-fluorophenyl)-6-(2,2,3-trifluorobutoxy)-1,3,5-triazine-2,4-diamine
CID 157249601
N,N-diethyl-4-hydrazinyl-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 80910058
N-[[4-methyl-2-(2,2,3,3-tetrafluoropropoxy)pyrimidin-5-yl]methyl]propan-2-amine
CID 83189356
N-methyl-1-[5-(2,2,3,3-tetrafluoropropoxy)-2-pyridinyl]propan-1-amine
CID 112584809
5-bromo-N-ethyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-amine
CID 114072952
2-tert-butyl-N-ethyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-amine
CID 80956887
6-[2-(dimethylamino)-2-methylpropoxy]-2-N,2-N-diethyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80871928
[5-methyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-4-yl]hydrazine
CID 80914213
5-methyl-N-propyl-4-(2,2,3,3-tetrafluoropropoxy)pyrimidin-2-amine
CID 80868216
(1R)-1-[4-(2,2,3,3-tetrafluoropropoxy)phenyl]propan-1-amine
CID 29004969
N,N-diethyl-1,3,5-triazin-2-amine;hydrochloride
CID 162306515

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine?
The IUPAC name of N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine (CID 175232801) is N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine.
What is the SMILES notation for N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine?
The canonical SMILES for N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine is CCN(CC)c1ncnc(OCC(F)(F)C(F)F)n1.
What is the InChIKey of N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine?
The InChIKey is LZRGWKJRCKUNEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F4N4O/c1-3-18(4-2)8-15-6-16-9(17-8)19-5-10(13,14)7(11)12/h6-7H,3-5H2,1-2H3.
What are the key properties of N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine?
N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine has a molecular weight of 282.24 g/mol, XLogP of 2.00, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-(2,2,3,3-tetrafluoropropoxy)-1,3,5-triazin-2-amine is sourced from PubChem (CID 175232801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).