[4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol

C12H21N5O3 — CID 81216915

IUPAC[4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol
SMILESCCOc1nc(NC)nc(N2CC(CO)OCC2C)n1
InChIInChI=1S/C12H21N5O3/c1-4-19-12-15-10(13-3)14-11(16-12)17-5-9(6-18)20-7-8(17)2/h8-9,18H,4-7H2,1-3H3,(H,13,14,15,16)
InChIKeyVUUNBUDHGHNREC-UHFFFAOYSA-N
MW283.33 g/mol
LogP-0.10
Rot. Bonds5

About [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol

[4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol (PubChem CID 81216915) has the molecular formula C12H21N5O3 and a molecular weight of 283.33 g/mol. Its IUPAC name is [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol.

Molecular Properties

Compound Name[4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol
PubChem CID81216915
Molecular FormulaC12H21N5O3
Molecular Weight283.33 g/mol
Exact Mass283.16
IUPAC Name[4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol
SMILESCCOc1nc(NC)nc(N2CC(CO)OCC2C)n1
InChIInChI=1S/C12H21N5O3/c1-4-19-12-15-10(13-3)14-11(16-12)17-5-9(6-18)20-7-8(17)2/h8-9,18H,4-7H2,1-3H3,(H,13,14,15,16)
InChIKeyVUUNBUDHGHNREC-UHFFFAOYSA-N
XLogP-0.10
TPSA92.63 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol?
The IUPAC name of [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol (CID 81216915) is [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol.
What is the SMILES notation for [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol?
The canonical SMILES for [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol is CCOc1nc(NC)nc(N2CC(CO)OCC2C)n1.
What is the InChIKey of [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol?
The InChIKey is VUUNBUDHGHNREC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O3/c1-4-19-12-15-10(13-3)14-11(16-12)17-5-9(6-18)20-7-8(17)2/h8-9,18H,4-7H2,1-3H3,(H,13,14,15,16).
What are the key properties of [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol?
[4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol has a molecular weight of 283.33 g/mol, XLogP of -0.10, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[4-ethoxy-6-(methylamino)-1,3,5-triazin-2-yl]-5-methylmorpholin-2-yl]methanol is sourced from PubChem (CID 81216915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).