4-(3-methoxy-4-methylphenyl)morpholine

C12H17NO2 — CID 22896545

IUPAC4-(3-methoxy-4-methylphenyl)morpholine
SMILESCOc1cc(N2CCOCC2)ccc1C
InChIInChI=1S/C12H17NO2/c1-10-3-4-11(9-12(10)14-2)13-5-7-15-8-6-13/h3-4,9H,5-8H2,1-2H3
InChIKeyKAUYJLLBKNEBDW-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.84
Rot. Bonds2

About 4-(3-methoxy-4-methylphenyl)morpholine

4-(3-methoxy-4-methylphenyl)morpholine (PubChem CID 22896545) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 4-(3-methoxy-4-methylphenyl)morpholine.

Molecular Properties

Compound Name4-(3-methoxy-4-methylphenyl)morpholine
PubChem CID22896545
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name4-(3-methoxy-4-methylphenyl)morpholine
SMILESCOc1cc(N2CCOCC2)ccc1C
InChIInChI=1S/C12H17NO2/c1-10-3-4-11(9-12(10)14-2)13-5-7-15-8-6-13/h3-4,9H,5-8H2,1-2H3
InChIKeyKAUYJLLBKNEBDW-UHFFFAOYSA-N
XLogP1.84
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methoxy-4-methylphenyl)morpholine?
The IUPAC name of 4-(3-methoxy-4-methylphenyl)morpholine (CID 22896545) is 4-(3-methoxy-4-methylphenyl)morpholine.
What is the SMILES notation for 4-(3-methoxy-4-methylphenyl)morpholine?
The canonical SMILES for 4-(3-methoxy-4-methylphenyl)morpholine is COc1cc(N2CCOCC2)ccc1C.
What is the InChIKey of 4-(3-methoxy-4-methylphenyl)morpholine?
The InChIKey is KAUYJLLBKNEBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-10-3-4-11(9-12(10)14-2)13-5-7-15-8-6-13/h3-4,9H,5-8H2,1-2H3.
What are the key properties of 4-(3-methoxy-4-methylphenyl)morpholine?
4-(3-methoxy-4-methylphenyl)morpholine has a molecular weight of 207.27 g/mol, XLogP of 1.84, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methoxy-4-methylphenyl)morpholine is sourced from PubChem (CID 22896545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).