2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine

C13H21N3O3 — CID 102634983

IUPAC2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine
SMILESCCCOc1cncc(OCC2CNCC(C)O2)n1
InChIInChI=1S/C13H21N3O3/c1-3-4-17-12-7-15-8-13(16-12)18-9-11-6-14-5-10(2)19-11/h7-8,10-11,14H,3-6,9H2,1-2H3
InChIKeyRMMDFAQGWZLLMR-UHFFFAOYSA-N
MW267.33 g/mol
LogP1.02
Rot. Bonds6

About 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine

2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine (PubChem CID 102634983) has the molecular formula C13H21N3O3 and a molecular weight of 267.33 g/mol. Its IUPAC name is 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine.

Molecular Properties

Compound Name2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine
PubChem CID102634983
Molecular FormulaC13H21N3O3
Molecular Weight267.33 g/mol
Exact Mass267.16
IUPAC Name2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine
SMILESCCCOc1cncc(OCC2CNCC(C)O2)n1
InChIInChI=1S/C13H21N3O3/c1-3-4-17-12-7-15-8-13(16-12)18-9-11-6-14-5-10(2)19-11/h7-8,10-11,14H,3-6,9H2,1-2H3
InChIKeyRMMDFAQGWZLLMR-UHFFFAOYSA-N
XLogP1.02
TPSA65.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine?
The IUPAC name of 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine (CID 102634983) is 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine.
What is the SMILES notation for 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine?
The canonical SMILES for 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine is CCCOc1cncc(OCC2CNCC(C)O2)n1.
What is the InChIKey of 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine?
The InChIKey is RMMDFAQGWZLLMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O3/c1-3-4-17-12-7-15-8-13(16-12)18-9-11-6-14-5-10(2)19-11/h7-8,10-11,14H,3-6,9H2,1-2H3.
What are the key properties of 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine?
2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine has a molecular weight of 267.33 g/mol, XLogP of 1.02, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine is sourced from PubChem (CID 102634983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).