2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide

C15H22N2O2S — CID 3610339

IUPAC2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide
SMILESCSc1ccccc1NC(=O)CN1CC(C)OC(C)C1
InChIInChI=1S/C15H22N2O2S/c1-11-8-17(9-12(2)19-11)10-15(18)16-13-6-4-5-7-14(13)20-3/h4-7,11-12H,8-10H2,1-3H3,(H,16,18)
InChIKeyOQTJZGNFFCWHKU-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.46
Rot. Bonds4

About 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide

2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide (PubChem CID 3610339) has the molecular formula C15H22N2O2S and a molecular weight of 294.42 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide
PubChem CID3610339
Molecular FormulaC15H22N2O2S
Molecular Weight294.42 g/mol
Exact Mass294.14
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide
SMILESCSc1ccccc1NC(=O)CN1CC(C)OC(C)C1
InChIInChI=1S/C15H22N2O2S/c1-11-8-17(9-12(2)19-11)10-15(18)16-13-6-4-5-7-14(13)20-3/h4-7,11-12H,8-10H2,1-3H3,(H,16,18)
InChIKeyOQTJZGNFFCWHKU-UHFFFAOYSA-N
XLogP2.46
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide (CID 3610339) is 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide is CSc1ccccc1NC(=O)CN1CC(C)OC(C)C1.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide?
The InChIKey is OQTJZGNFFCWHKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2S/c1-11-8-17(9-12(2)19-11)10-15(18)16-13-6-4-5-7-14(13)20-3/h4-7,11-12H,8-10H2,1-3H3,(H,16,18).
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide?
2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide has a molecular weight of 294.42 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylsulfanylphenyl)acetamide is sourced from PubChem (CID 3610339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).