2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide

C14H16N2O2S — CID 71985318

IUPAC2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide
SMILESCc1ccc(OCC(=O)NCc2sccc2C)nc1
InChIInChI=1S/C14H16N2O2S/c1-10-3-4-14(16-7-10)18-9-13(17)15-8-12-11(2)5-6-19-12/h3-7H,8-9H2,1-2H3,(H,15,17)
InChIKeyPRKAIBIQQABELD-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.46
Rot. Bonds5

About 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide

2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide (PubChem CID 71985318) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide
PubChem CID71985318
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC Name2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide
SMILESCc1ccc(OCC(=O)NCc2sccc2C)nc1
InChIInChI=1S/C14H16N2O2S/c1-10-3-4-14(16-7-10)18-9-13(17)15-8-12-11(2)5-6-19-12/h3-7H,8-9H2,1-2H3,(H,15,17)
InChIKeyPRKAIBIQQABELD-UHFFFAOYSA-N
XLogP2.46
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
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-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The IUPAC name of 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide (CID 71985318) is 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide.
What is the SMILES notation for 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The canonical SMILES for 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide is Cc1ccc(OCC(=O)NCc2sccc2C)nc1.
What is the InChIKey of 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The InChIKey is PRKAIBIQQABELD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c1-10-3-4-14(16-7-10)18-9-13(17)15-8-12-11(2)5-6-19-12/h3-7H,8-9H2,1-2H3,(H,15,17).
What are the key properties of 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide?
2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide has a molecular weight of 276.36 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-methyl-2-pyridinyl)oxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide is sourced from PubChem (CID 71985318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).