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

C16H21F6N5O2 — CID 3237373

IUPACN-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESFC(F)(F)C(Oc1nc(NC2CCCCC2)nc(N2CCOCC2)n1)C(F)(F)F
InChIInChI=1S/C16H21F6N5O2/c17-15(18,19)11(16(20,21)22)29-14-25-12(23-10-4-2-1-3-5-10)24-13(26-14)27-6-8-28-9-7-27/h10-11H,1-9H2,(H,23,24,25,26)
InChIKeyDLJZGEARLIQLAE-UHFFFAOYSA-N
MW429.37 g/mol
LogP3.32
Rot. Bonds5

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

N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 3237373) has the molecular formula C16H21F6N5O2 and a molecular weight of 429.37 g/mol. Its IUPAC name is N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID3237373
Molecular FormulaC16H21F6N5O2
Molecular Weight429.37 g/mol
Exact Mass429.16
IUPAC NameN-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESFC(F)(F)C(Oc1nc(NC2CCCCC2)nc(N2CCOCC2)n1)C(F)(F)F
InChIInChI=1S/C16H21F6N5O2/c17-15(18,19)11(16(20,21)22)29-14-25-12(23-10-4-2-1-3-5-10)24-13(26-14)27-6-8-28-9-7-27/h10-11H,1-9H2,(H,23,24,25,26)
InChIKeyDLJZGEARLIQLAE-UHFFFAOYSA-N
XLogP3.32
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Launch Full Analysis

Related Compounds

N-cyclohexyl-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
CID 767098
2-Ethylamino-4-piperidin-1-yl-6-(2,2,2-trifluoro-2-trifluoromethylethoxy)-[1,3,5]-triazine
CID 633000
N-cyclohexyl-4,6-bis[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-1,3,5-triazin-2-amine
CID 550625
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-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-[(2R)-butan-2-yl]-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 1115550
N-[(2S)-butan-2-yl]-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 1115551
4-(1-piperidinyl)-N-propyl-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethoxy]-1,3,5-triazin-2-amine
CID 2192487
N-butyl-4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(piperidin-1-yl)-1,3,5-triazin-2-amine
CID 2192544
4-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-6-(piperidin-1-yl)-N-(propan-2-yl)-1,3,5-triazin-2-amine
CID 3541525
N-cyclohexyl-6-[(1,1,1,3,3,3-hexafluoropropan-2-yl)oxy]-N'-methyl-1,3,5-triazine-2,4-diamine
CID 3910720

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 3237373) is N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine is FC(F)(F)C(Oc1nc(NC2CCCCC2)nc(N2CCOCC2)n1)C(F)(F)F.
What is the InChIKey of N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is DLJZGEARLIQLAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21F6N5O2/c17-15(18,19)11(16(20,21)22)29-14-25-12(23-10-4-2-1-3-5-10)24-13(26-14)27-6-8-28-9-7-27/h10-11H,1-9H2,(H,23,24,25,26).
What are the key properties of N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 429.37 g/mol, XLogP of 3.32, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 3237373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).