2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine

C12H19N3O2 — CID 114775795

IUPAC2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine
SMILESCc1ccnc(OCC2CNCC(C)(C)O2)n1
InChIInChI=1S/C12H19N3O2/c1-9-4-5-14-11(15-9)16-7-10-6-13-8-12(2,3)17-10/h4-5,10,13H,6-8H2,1-3H3
InChIKeyZLUMZNPFZFVTQQ-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.93
Rot. Bonds3

About 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine

2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine (PubChem CID 114775795) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine.

Molecular Properties

Compound Name2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine
PubChem CID114775795
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine
SMILESCc1ccnc(OCC2CNCC(C)(C)O2)n1
InChIInChI=1S/C12H19N3O2/c1-9-4-5-14-11(15-9)16-7-10-6-13-8-12(2,3)17-10/h4-5,10,13H,6-8H2,1-3H3
InChIKeyZLUMZNPFZFVTQQ-UHFFFAOYSA-N
XLogP0.93
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine?
The IUPAC name of 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine (CID 114775795) is 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine.
What is the SMILES notation for 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine?
The canonical SMILES for 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine is Cc1ccnc(OCC2CNCC(C)(C)O2)n1.
What is the InChIKey of 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine?
The InChIKey is ZLUMZNPFZFVTQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-9-4-5-14-11(15-9)16-7-10-6-13-8-12(2,3)17-10/h4-5,10,13H,6-8H2,1-3H3.
What are the key properties of 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine?
2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine has a molecular weight of 237.30 g/mol, XLogP of 0.93, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-[(4-methylpyrimidin-2-yl)oxymethyl]morpholine is sourced from PubChem (CID 114775795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).