4-(3,5-dimethoxyphenyl)morpholine

C12H17NO3 — CID 13479495

IUPAC4-(3,5-dimethoxyphenyl)morpholine
SMILESCOc1cc(OC)cc(N2CCOCC2)c1
InChIInChI=1S/C12H17NO3/c1-14-11-7-10(8-12(9-11)15-2)13-3-5-16-6-4-13/h7-9H,3-6H2,1-2H3
InChIKeySZUPQAWPGHAUPM-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.54
Rot. Bonds3

About 4-(3,5-dimethoxyphenyl)morpholine

4-(3,5-dimethoxyphenyl)morpholine (PubChem CID 13479495) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is 4-(3,5-dimethoxyphenyl)morpholine.

Molecular Properties

Compound Name4-(3,5-dimethoxyphenyl)morpholine
PubChem CID13479495
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name4-(3,5-dimethoxyphenyl)morpholine
SMILESCOc1cc(OC)cc(N2CCOCC2)c1
InChIInChI=1S/C12H17NO3/c1-14-11-7-10(8-12(9-11)15-2)13-3-5-16-6-4-13/h7-9H,3-6H2,1-2H3
InChIKeySZUPQAWPGHAUPM-UHFFFAOYSA-N
XLogP1.54
TPSA30.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethoxyphenyl)morpholine?
The IUPAC name of 4-(3,5-dimethoxyphenyl)morpholine (CID 13479495) is 4-(3,5-dimethoxyphenyl)morpholine.
What is the SMILES notation for 4-(3,5-dimethoxyphenyl)morpholine?
The canonical SMILES for 4-(3,5-dimethoxyphenyl)morpholine is COc1cc(OC)cc(N2CCOCC2)c1.
What is the InChIKey of 4-(3,5-dimethoxyphenyl)morpholine?
The InChIKey is SZUPQAWPGHAUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-14-11-7-10(8-12(9-11)15-2)13-3-5-16-6-4-13/h7-9H,3-6H2,1-2H3.
What are the key properties of 4-(3,5-dimethoxyphenyl)morpholine?
4-(3,5-dimethoxyphenyl)morpholine has a molecular weight of 223.27 g/mol, XLogP of 1.54, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethoxyphenyl)morpholine is sourced from PubChem (CID 13479495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).