4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine

C8H10F3N5O — CID 596474

IUPAC4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine
SMILESNc1nc(N2CCOCC2)nc(C(F)(F)F)n1
InChIInChI=1S/C8H10F3N5O/c9-8(10,11)5-13-6(12)15-7(14-5)16-1-3-17-4-2-16/h1-4H2,(H2,12,13,14,15)
InChIKeyMQXCFTXBBPWVQM-UHFFFAOYSA-N
MW249.20 g/mol
LogP0.31
Rot. Bonds1

About 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine

4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine (PubChem CID 596474) has the molecular formula C8H10F3N5O and a molecular weight of 249.20 g/mol. Its IUPAC name is 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine
PubChem CID596474
Molecular FormulaC8H10F3N5O
Molecular Weight249.20 g/mol
Exact Mass249.08
IUPAC Name4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine
SMILESNc1nc(N2CCOCC2)nc(C(F)(F)F)n1
InChIInChI=1S/C8H10F3N5O/c9-8(10,11)5-13-6(12)15-7(14-5)16-1-3-17-4-2-16/h1-4H2,(H2,12,13,14,15)
InChIKeyMQXCFTXBBPWVQM-UHFFFAOYSA-N
XLogP0.31
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.20
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(Diethylamino)-6-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
CID 1521564
1,3,5-Triazin-2-amine, 4-methoxy-6-(4-morpholinylmethyl)-
CID 199954
1-Piperazineethanol, 4-(4-amino-6-trifluoromethyl-2-s-triazinyl)-
CID 3041956
6-(Ethylamino)-4-morpholin-4-yl-1,3,5-triazine-2-carbonitrile
CID 672046
4-Dimethylamino-6-morpholin-4-yl-[1,3,5]triazine-2-carbonitrile
CID 1088873
1,3,5-Triazine, 2-methyl-4-(4-morpholinyl)-6-(trifluoromethyl)-
CID 3041949
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-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
1,3,5-Triazine, 2-morpholino-4,6-bis(perfluoro-tert-butyl)-
CID 549881

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine (CID 596474) is 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine is Nc1nc(N2CCOCC2)nc(C(F)(F)F)n1.
What is the InChIKey of 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine?
The InChIKey is MQXCFTXBBPWVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F3N5O/c9-8(10,11)5-13-6(12)15-7(14-5)16-1-3-17-4-2-16/h1-4H2,(H2,12,13,14,15).
What are the key properties of 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine?
4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine has a molecular weight of 249.20 g/mol, XLogP of 0.31, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-6-(trifluoromethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 596474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).