6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine

C16H25NO3 — CID 106292512

IUPAC6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine
SMILESCCCC1(C)CNCC(c2ccc(OC)cc2OC)O1
InChIInChI=1S/C16H25NO3/c1-5-8-16(2)11-17-10-15(20-16)13-7-6-12(18-3)9-14(13)19-4/h6-7,9,15,17H,5,8,10-11H2,1-4H3
InChIKeyUHDNTGVUZPYGPT-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.92
Rot. Bonds5

About 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine

6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine (PubChem CID 106292512) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine.

Molecular Properties

Compound Name6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine
PubChem CID106292512
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC Name6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine
SMILESCCCC1(C)CNCC(c2ccc(OC)cc2OC)O1
InChIInChI=1S/C16H25NO3/c1-5-8-16(2)11-17-10-15(20-16)13-7-6-12(18-3)9-14(13)19-4/h6-7,9,15,17H,5,8,10-11H2,1-4H3
InChIKeyUHDNTGVUZPYGPT-UHFFFAOYSA-N
XLogP2.92
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine?
The IUPAC name of 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine (CID 106292512) is 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine.
What is the SMILES notation for 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine?
The canonical SMILES for 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine is CCCC1(C)CNCC(c2ccc(OC)cc2OC)O1.
What is the InChIKey of 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine?
The InChIKey is UHDNTGVUZPYGPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-5-8-16(2)11-17-10-15(20-16)13-7-6-12(18-3)9-14(13)19-4/h6-7,9,15,17H,5,8,10-11H2,1-4H3.
What are the key properties of 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine?
6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine has a molecular weight of 279.38 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-dimethoxyphenyl)-2-methyl-2-propylmorpholine is sourced from PubChem (CID 106292512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).