4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine

C9H11F3N4O — CID 3041949

IUPAC4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine
SMILESCc1nc(N2CCOCC2)nc(C(F)(F)F)n1
InChIInChI=1S/C9H11F3N4O/c1-6-13-7(9(10,11)12)15-8(14-6)16-2-4-17-5-3-16/h2-5H2,1H3
InChIKeyCBEZFCIXTQVPOF-UHFFFAOYSA-N
MW248.21 g/mol
LogP1.04
Rot. Bonds1

About 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine

4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine (PubChem CID 3041949) has the molecular formula C9H11F3N4O and a molecular weight of 248.21 g/mol. Its IUPAC name is 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine
PubChem CID3041949
Molecular FormulaC9H11F3N4O
Molecular Weight248.21 g/mol
Exact Mass248.09
IUPAC Name4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine
SMILESCc1nc(N2CCOCC2)nc(C(F)(F)F)n1
InChIInChI=1S/C9H11F3N4O/c1-6-13-7(9(10,11)12)15-8(14-6)16-2-4-17-5-3-16/h2-5H2,1H3
InChIKeyCBEZFCIXTQVPOF-UHFFFAOYSA-N
XLogP1.04
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.21
LogP ≤ 51.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(Diethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
CID 1521564
6-Ethoxy-4-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
CID 729542
1,3,5-Triazin-2-amine, 4-methoxy-6-(4-morpholinylmethyl)-
CID 199954
s-Triazine, 2,4-dimorpholino-6-methyl-
CID 33387
4-Dimethylamino-6-morpholin-4-yl-[1,3,5]triazine-2-carbonitrile
CID 1088873
1,3,5-Triazine, 2-ethyl-4-methoxy-6-(4-morpholinyl)-
CID 199903
1,3,5-Triazine-2-amine, N-methyl-4-(4-morpholinyl)-6-(trifluoromethyl)-
CID 3041953
1,3,5-Triazine-2-amine, N-(1-methylethyl)-4-(4-morpholinyl)-6-(trifluoromethyl)-
CID 3041962
Vbkrvbwyslcrfo-uhfffaoysa-
CID 21605225
2-Methyl-4-(4-morpholinyl)-1,3,5-triazine
CID 824816
2-Cyano-4-methoxy-6-morpholyl-1,3,5-triazine
CID 85791643
6-(difluoromethyl)-2-N-ethyl-2-N-(2-methoxyethyl)-1,3,5-triazine-2,4-diamine
CID 132395027

Frequently Asked Questions

What is the IUPAC name of 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine?
The IUPAC name of 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine (CID 3041949) is 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine.
What is the SMILES notation for 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine?
The canonical SMILES for 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine is Cc1nc(N2CCOCC2)nc(C(F)(F)F)n1.
What is the InChIKey of 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine?
The InChIKey is CBEZFCIXTQVPOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F3N4O/c1-6-13-7(9(10,11)12)15-8(14-6)16-2-4-17-5-3-16/h2-5H2,1H3.
What are the key properties of 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine?
4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine has a molecular weight of 248.21 g/mol, XLogP of 1.04, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-methyl-6-(trifluoromethyl)-1,3,5-triazin-2-yl]morpholine is sourced from PubChem (CID 3041949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).