4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

C12H19N5O2 — CID 80872862

IUPAC4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(OC2CCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O2/c1-13-10-14-11(17-5-7-18-8-6-17)16-12(15-10)19-9-3-2-4-9/h9H,2-8H2,1H3,(H,13,14,15,16)
InChIKeyIQLUQBJTQMNWDY-UHFFFAOYSA-N
MW265.32 g/mol
LogP0.68
Rot. Bonds4

About 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 80872862) has the molecular formula C12H19N5O2 and a molecular weight of 265.32 g/mol. Its IUPAC name is 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID80872862
Molecular FormulaC12H19N5O2
Molecular Weight265.32 g/mol
Exact Mass265.15
IUPAC Name4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCNc1nc(OC2CCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N5O2/c1-13-10-14-11(17-5-7-18-8-6-17)16-12(15-10)19-9-3-2-4-9/h9H,2-8H2,1H3,(H,13,14,15,16)
InChIKeyIQLUQBJTQMNWDY-UHFFFAOYSA-N
XLogP0.68
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.32
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 80872862) is 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is CNc1nc(OC2CCC2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is IQLUQBJTQMNWDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O2/c1-13-10-14-11(17-5-7-18-8-6-17)16-12(15-10)19-9-3-2-4-9/h9H,2-8H2,1H3,(H,13,14,15,16).
What are the key properties of 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 265.32 g/mol, XLogP of 0.68, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyloxy-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80872862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).