2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine

C14H22N2O4 — CID 103173438

IUPAC2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine
SMILESCOc1ccnc(COCC2CNCC(C)O2)c1OC
InChIInChI=1S/C14H22N2O4/c1-10-6-15-7-11(20-10)8-19-9-12-14(18-3)13(17-2)4-5-16-12/h4-5,10-11,15H,6-9H2,1-3H3
InChIKeySEZIYRGVAGTNNZ-UHFFFAOYSA-N
MW282.34 g/mol
LogP0.99
Rot. Bonds6

About 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine

2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine (PubChem CID 103173438) has the molecular formula C14H22N2O4 and a molecular weight of 282.34 g/mol. Its IUPAC name is 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine.

Molecular Properties

Compound Name2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine
PubChem CID103173438
Molecular FormulaC14H22N2O4
Molecular Weight282.34 g/mol
Exact Mass282.16
IUPAC Name2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine
SMILESCOc1ccnc(COCC2CNCC(C)O2)c1OC
InChIInChI=1S/C14H22N2O4/c1-10-6-15-7-11(20-10)8-19-9-12-14(18-3)13(17-2)4-5-16-12/h4-5,10-11,15H,6-9H2,1-3H3
InChIKeySEZIYRGVAGTNNZ-UHFFFAOYSA-N
XLogP0.99
TPSA61.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine?
The IUPAC name of 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine (CID 103173438) is 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine.
What is the SMILES notation for 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine?
The canonical SMILES for 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine is COc1ccnc(COCC2CNCC(C)O2)c1OC.
What is the InChIKey of 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine?
The InChIKey is SEZIYRGVAGTNNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4/c1-10-6-15-7-11(20-10)8-19-9-12-14(18-3)13(17-2)4-5-16-12/h4-5,10-11,15H,6-9H2,1-3H3.
What are the key properties of 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine?
2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine has a molecular weight of 282.34 g/mol, XLogP of 0.99, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,4-dimethoxy-2-pyridinyl)methoxymethyl]-6-methylmorpholine is sourced from PubChem (CID 103173438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).