4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine

C16H23F6N5O2 — CID 3942684

IUPAC4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine
SMILESCCCN(CCC)c1nc(OC(C(F)(F)F)C(F)(F)F)nc(N2CCOCC2)n1
InChIInChI=1S/C16H23F6N5O2/c1-3-5-26(6-4-2)12-23-13(27-7-9-28-10-8-27)25-14(24-12)29-11(15(17,18)19)16(20,21)22/h11H,3-10H2,1-2H3
InChIKeyHCIZYGPKKHBYAD-UHFFFAOYSA-N
MW431.38 g/mol
LogP3.21
Rot. Bonds8

About 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine

4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine (PubChem CID 3942684) has the molecular formula C16H23F6N5O2 and a molecular weight of 431.38 g/mol. Its IUPAC name is 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine
PubChem CID3942684
Molecular FormulaC16H23F6N5O2
Molecular Weight431.38 g/mol
Exact Mass431.18
IUPAC Name4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine
SMILESCCCN(CCC)c1nc(OC(C(F)(F)F)C(F)(F)F)nc(N2CCOCC2)n1
InChIInChI=1S/C16H23F6N5O2/c1-3-5-26(6-4-2)12-23-13(27-7-9-28-10-8-27)25-14(24-12)29-11(15(17,18)19)16(20,21)22/h11H,3-10H2,1-2H3
InChIKeyHCIZYGPKKHBYAD-UHFFFAOYSA-N
XLogP3.21
TPSA63.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500431.38
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

1,3,5-Triazine, 2,4-bis(2,2,2-trifluoro-1-trifluoromethylethoxy)-6-(4-morpholyl)-
CID 549986
1,3,5-Triazine, 2,4-bis(2,2,2-trifluoro-1-trifluoromethylethoxy)-6-(1-piperidyl)-
CID 550156
2,4-Bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine
CID 3912928
4-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-4-methylmorpholinium tetrafluoroborate
CID 11631268
2-[(1,1,1,3,3,3-Hexafluoropropan-2-yl)oxy]-4-(morpholin-4-yl)-6-(piperidin-1-yl)-1,3,5-triazine
CID 1068865
N-tert-butyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 1113192
2-(4-Morpholinyl)-4,6-bis(2,2,2-trifluoroethoxy)-1,3,5-triazine
CID 1227424
N-butyl-4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
CID 2192507
(Methylpropyl){4-morpholin-4-yl-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy](1,3,5-triazin-2-yl)}amine
CID 3094637
N-methyl-N-{4-(4-morpholinyl)-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-1,3,5-triazin-2-yl}amine
CID 3435092
4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-N,N-dimethyl-6-(morpholin-4-yl)-1,3,5-triazin-2-amine
CID 3942683
2-[(1,1,1,3,3,3-Hexafluoropropan-2-yl)oxy]-4,6-di(morpholin-4-yl)-1,3,5-triazine
CID 3942685

Frequently Asked Questions

What is the IUPAC name of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine (CID 3942684) is 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine is CCCN(CCC)c1nc(OC(C(F)(F)F)C(F)(F)F)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine?
The InChIKey is HCIZYGPKKHBYAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23F6N5O2/c1-3-5-26(6-4-2)12-23-13(27-7-9-28-10-8-27)25-14(24-12)29-11(15(17,18)19)16(20,21)22/h11H,3-10H2,1-2H3.
What are the key properties of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine?
4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine has a molecular weight of 431.38 g/mol, XLogP of 3.21, 8 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-N,N-dipropyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 3942684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).