4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine

C14H22N2O2 — CID 47090459

IUPAC4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine
SMILESCOc1c(C)cnc(CN2CCOCC2C)c1C
InChIInChI=1S/C14H22N2O2/c1-10-7-15-13(12(3)14(10)17-4)8-16-5-6-18-9-11(16)2/h7,11H,5-6,8-9H2,1-4H3
InChIKeyMYXTXHBUFQBCLL-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.93
Rot. Bonds3

About 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine

4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine (PubChem CID 47090459) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine.

Molecular Properties

Compound Name4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine
PubChem CID47090459
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine
SMILESCOc1c(C)cnc(CN2CCOCC2C)c1C
InChIInChI=1S/C14H22N2O2/c1-10-7-15-13(12(3)14(10)17-4)8-16-5-6-18-9-11(16)2/h7,11H,5-6,8-9H2,1-4H3
InChIKeyMYXTXHBUFQBCLL-UHFFFAOYSA-N
XLogP1.93
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine?
The IUPAC name of 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine (CID 47090459) is 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine.
What is the SMILES notation for 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine?
The canonical SMILES for 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine is COc1c(C)cnc(CN2CCOCC2C)c1C.
What is the InChIKey of 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine?
The InChIKey is MYXTXHBUFQBCLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10-7-15-13(12(3)14(10)17-4)8-16-5-6-18-9-11(16)2/h7,11H,5-6,8-9H2,1-4H3.
What are the key properties of 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine?
4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine has a molecular weight of 250.34 g/mol, XLogP of 1.93, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-3-methylmorpholine is sourced from PubChem (CID 47090459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).