2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide

C16H24N2O3 — CID 650107

IUPAC2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
SMILESCc1cc(C)cc(OCC(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C16H24N2O3/c1-13-9-14(2)11-15(10-13)21-12-16(19)17-3-4-18-5-7-20-8-6-18/h9-11H,3-8,12H2,1-2H3,(H,17,19)
InChIKeyDXOBJISVIDIQLV-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.13
Rot. Bonds6

About 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide

2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 650107) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID650107
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
SMILESCc1cc(C)cc(OCC(=O)NCCN2CCOCC2)c1
InChIInChI=1S/C16H24N2O3/c1-13-9-14(2)11-15(10-13)21-12-16(19)17-3-4-18-5-7-20-8-6-18/h9-11H,3-8,12H2,1-2H3,(H,17,19)
InChIKeyDXOBJISVIDIQLV-UHFFFAOYSA-N
XLogP1.13
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide (CID 650107) is 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide is Cc1cc(C)cc(OCC(=O)NCCN2CCOCC2)c1.
What is the InChIKey of 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is DXOBJISVIDIQLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-13-9-14(2)11-15(10-13)21-12-16(19)17-3-4-18-5-7-20-8-6-18/h9-11H,3-8,12H2,1-2H3,(H,17,19).
What are the key properties of 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide has a molecular weight of 292.38 g/mol, XLogP of 1.13, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 650107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).