4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine

C13H21N5O3 — CID 703119

IUPAC4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine
SMILESCCOc1nc(N2CCOCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C13H21N5O3/c1-2-21-13-15-11(17-3-7-19-8-4-17)14-12(16-13)18-5-9-20-10-6-18/h2-10H2,1H3
InChIKeyAJERMAPJGURCCC-UHFFFAOYSA-N
MW295.34 g/mol
LogP-0.06
Rot. Bonds4

About 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine

4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine (PubChem CID 703119) has the molecular formula C13H21N5O3 and a molecular weight of 295.34 g/mol. Its IUPAC name is 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine
PubChem CID703119
Molecular FormulaC13H21N5O3
Molecular Weight295.34 g/mol
Exact Mass295.16
IUPAC Name4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine
SMILESCCOc1nc(N2CCOCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C13H21N5O3/c1-2-21-13-15-11(17-3-7-19-8-4-17)14-12(16-13)18-5-9-20-10-6-18/h2-10H2,1H3
InChIKeyAJERMAPJGURCCC-UHFFFAOYSA-N
XLogP-0.06
TPSA72.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.34
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine?
The IUPAC name of 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine (CID 703119) is 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine.
What is the SMILES notation for 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine?
The canonical SMILES for 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine is CCOc1nc(N2CCOCC2)nc(N2CCOCC2)n1.
What is the InChIKey of 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine?
The InChIKey is AJERMAPJGURCCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5O3/c1-2-21-13-15-11(17-3-7-19-8-4-17)14-12(16-13)18-5-9-20-10-6-18/h2-10H2,1H3.
What are the key properties of 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine?
4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine has a molecular weight of 295.34 g/mol, XLogP of -0.06, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxy-6-morpholin-4-yl-1,3,5-triazin-2-yl)morpholine is sourced from PubChem (CID 703119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).