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

C11H13F6N5O2 — CID 3435092

IUPAC4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(OC(C(F)(F)F)C(F)(F)F)nc(N2CCOCC2)n1
InChIInChI=1S/C11H13F6N5O2/c1-18-7-19-8(22-2-4-23-5-3-22)21-9(20-7)24-6(10(12,13)14)11(15,16)17/h6H,2-5H2,1H3,(H,18,19,20,21)
InChIKeyAYIBWLKZSJXMAL-UHFFFAOYSA-N
MW361.25 g/mol
LogP1.62
Rot. Bonds4

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

4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 3435092) has the molecular formula C11H13F6N5O2 and a molecular weight of 361.25 g/mol. Its IUPAC name is 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID3435092
Molecular FormulaC11H13F6N5O2
Molecular Weight361.25 g/mol
Exact Mass361.10
IUPAC Name4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(OC(C(F)(F)F)C(F)(F)F)nc(N2CCOCC2)n1
InChIInChI=1S/C11H13F6N5O2/c1-18-7-19-8(22-2-4-23-5-3-22)21-9(20-7)24-6(10(12,13)14)11(15,16)17/h6H,2-5H2,1H3,(H,18,19,20,21)
InChIKeyAYIBWLKZSJXMAL-UHFFFAOYSA-N
XLogP1.62
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.25
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

4-methoxy-N-methyl-6-(4-morpholinyl)-1,3,5-triazin-2-amine
CID 976569
N-methyl-4-(4-morpholinyl)-6-(2,2,2-trifluoroethoxy)-1,3,5-triazin-2-amine
CID 879151
2-Ethylamino-4-piperidin-1-yl-6-(2,2,2-trifluoro-2-trifluoromethylethoxy)-[1,3,5]-triazine
CID 633000
4-(4,6-Dimethoxy-1,3,5-triazin-2-yl)morpholin-4-ium tetrafluoroborate
CID 44558575
N-Ethyl-4,6-bis[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-1,3,5-triazin-2-amine
CID 549848
1,3,5-Triazine, 2,4-bis(2,2,2-trifluoro-1-trifluoromethylethoxy)-6-(4-morpholyl)-
CID 549986
2,4-Bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(4-methylpiperazin-1-yl)-1,3,5-triazine
CID 3912928
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
4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(morpholin-4-yl)-N-(prop-2-en-1-yl)-1,3,5-triazin-2-amine
CID 2827457
(Methylpropyl){4-morpholin-4-yl-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy](1,3,5-triazin-2-yl)}amine
CID 3094637

Frequently Asked Questions

What is the IUPAC name of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 3435092) is 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is CNc1nc(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)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is AYIBWLKZSJXMAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F6N5O2/c1-18-7-19-8(22-2-4-23-5-3-22)21-9(20-7)24-6(10(12,13)14)11(15,16)17/h6H,2-5H2,1H3,(H,18,19,20,21).
What are the key properties of 4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 361.25 g/mol, XLogP of 1.62, 4 rotatable bonds, 1 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)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 3435092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).