2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide

C16H24N2O3 — CID 18892490

IUPAC2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
SMILESCc1cccc(C)c1OCC(=O)NCCN1CCOCC1
InChIInChI=1S/C16H24N2O3/c1-13-4-3-5-14(2)16(13)21-12-15(19)17-6-7-18-8-10-20-11-9-18/h3-5H,6-12H2,1-2H3,(H,17,19)
InChIKeyKGGJAHVYQQYMMT-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.13
Rot. Bonds6

About 2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide

2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide (PubChem CID 18892490) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
PubChem CID18892490
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide
SMILESCc1cccc(C)c1OCC(=O)NCCN1CCOCC1
InChIInChI=1S/C16H24N2O3/c1-13-4-3-5-14(2)16(13)21-12-15(19)17-6-7-18-8-10-20-11-9-18/h3-5H,6-12H2,1-2H3,(H,17,19)
InChIKeyKGGJAHVYQQYMMT-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-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The IUPAC name of 2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide (CID 18892490) is 2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide.
What is the SMILES notation for 2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The canonical SMILES for 2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide is Cc1cccc(C)c1OCC(=O)NCCN1CCOCC1.
What is the InChIKey of 2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
The InChIKey is KGGJAHVYQQYMMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-13-4-3-5-14(2)16(13)21-12-15(19)17-6-7-18-8-10-20-11-9-18/h3-5H,6-12H2,1-2H3,(H,17,19).
What are the key properties of 2-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide?
2-(2,6-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-(2,6-dimethylphenoxy)-N-(2-morpholin-4-ylethyl)acetamide is sourced from PubChem (CID 18892490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).