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

C9H13F2N5O2 — CID 82008989

IUPAC4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESNc1nc(OCC(F)F)nc(N2CCOCC2)n1
InChIInChI=1S/C9H13F2N5O2/c10-6(11)5-18-9-14-7(12)13-8(15-9)16-1-3-17-4-2-16/h6H,1-5H2,(H2,12,13,14,15)
InChIKeyGNWAWFKCFUNCIO-UHFFFAOYSA-N
MW261.23 g/mol
LogP-0.07
Rot. Bonds4

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

4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 82008989) has the molecular formula C9H13F2N5O2 and a molecular weight of 261.23 g/mol. Its IUPAC name is 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID82008989
Molecular FormulaC9H13F2N5O2
Molecular Weight261.23 g/mol
Exact Mass261.10
IUPAC Name4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESNc1nc(OCC(F)F)nc(N2CCOCC2)n1
InChIInChI=1S/C9H13F2N5O2/c10-6(11)5-18-9-14-7(12)13-8(15-9)16-1-3-17-4-2-16/h6H,1-5H2,(H2,12,13,14,15)
InChIKeyGNWAWFKCFUNCIO-UHFFFAOYSA-N
XLogP-0.07
TPSA86.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.23
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(2,2-difluoroethoxy)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 82009481
4-hexoxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80862100
4-(1-ethoxypropan-2-yloxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 103491737
4-morpholin-4-yl-6-(oxan-4-yloxy)-1,3,5-triazin-2-amine
CID 80873023
4-cyclohexyloxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80858635
4-(azepan-1-yl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80764187
4-(3-chlorophenoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80865052
4-morpholin-4-yl-6-propan-2-yl-1,3,5-triazin-2-amine
CID 63868604
4-(3-methylphenoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80866604
4-morpholin-4-yl-6-propan-2-ylsulfanyl-1,3,5-triazin-2-amine
CID 80885930
4-(2-methylcyclohexyl)oxy-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80845160
4-N,4-N-dimethyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 27396187

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 82008989) is 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine is Nc1nc(OCC(F)F)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is GNWAWFKCFUNCIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F2N5O2/c10-6(11)5-18-9-14-7(12)13-8(15-9)16-1-3-17-4-2-16/h6H,1-5H2,(H2,12,13,14,15).
What are the key properties of 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 261.23 g/mol, XLogP of -0.07, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-difluoroethoxy)-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 82008989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).