4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine

C12H19N3O3 — CID 2730598

IUPAC4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine
SMILESCOCCOc1cc(C)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N3O3/c1-10-9-11(18-8-7-16-2)14-12(13-10)15-3-5-17-6-4-15/h9H,3-8H2,1-2H3
InChIKeyFOGRDMNALDXQQQ-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.65
Rot. Bonds5

About 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine

4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine (PubChem CID 2730598) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine
PubChem CID2730598
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC Name4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine
SMILESCOCCOc1cc(C)nc(N2CCOCC2)n1
InChIInChI=1S/C12H19N3O3/c1-10-9-11(18-8-7-16-2)14-12(13-10)15-3-5-17-6-4-15/h9H,3-8H2,1-2H3
InChIKeyFOGRDMNALDXQQQ-UHFFFAOYSA-N
XLogP0.65
TPSA56.71 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(2-Methoxyethoxy)-6-methylpyrimidin-2-amine
CID 3777900
4-(2,2-Dimethylpropoxy)-6-methylpyrimidin-2-amine
CID 57063267
4-({[6-Methyl-2-(methylthio)pyrimidin-4-yl]oxy}acetyl)morpholine
CID 3243664
2-Isopropylamino-4-(2-chloroallyloxy)-6-methyl-pyrimidine
CID 76330728
2,4-Diethoxy-6-methylpyrimidine
CID 260112
2-(4-Cyclohexyl-piperazin-1-yl)-4-ethoxy-6-methyl-pyrimidine
CID 656154
2-Pyrimidinamine, 4-methyl-N-(1-methylethyl)-6-(2-methylpropoxy)-
CID 56843735
4-[4-Methyl-6-(2-morpholin-4-ylethoxy)pyrimidin-2-yl]morpholine
CID 697263
Ethanamine, 2-((2,6-dimethyl-4-pyrimidinyl)oxy)-N,N-dimethyl-, hydrochloride (1:1)
CID 51293
Ethanamine, N,N-diethyl-2-((2,6-dimethyl-4-pyrimidinyl)oxy)-, monohydrochloride
CID 51295
N,N-diethyl-4-methoxy-6-methylpyrimidin-2-amine
CID 13789821
2-[Cyclopropyl(methyl)amino]-1-[4-(4-ethoxy-6-methylpyrimidin-2-yl)piperazin-1-yl]ethanone
CID 53588424

Frequently Asked Questions

What is the IUPAC name of 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine?
The IUPAC name of 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine (CID 2730598) is 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine.
What is the SMILES notation for 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine?
The canonical SMILES for 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine is COCCOc1cc(C)nc(N2CCOCC2)n1.
What is the InChIKey of 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine?
The InChIKey is FOGRDMNALDXQQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-10-9-11(18-8-7-16-2)14-12(13-10)15-3-5-17-6-4-15/h9H,3-8H2,1-2H3.
What are the key properties of 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine?
4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine has a molecular weight of 253.30 g/mol, XLogP of 0.65, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(2-methoxyethoxy)-6-methylpyrimidin-2-yl]morpholine is sourced from PubChem (CID 2730598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).