N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide

C15H17NO2S — CID 67511212

IUPACN-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
SMILESCc1ccc(OCC(=O)N(C)Cc2cccs2)cc1
InChIInChI=1S/C15H17NO2S/c1-12-5-7-13(8-6-12)18-11-15(17)16(2)10-14-4-3-9-19-14/h3-9H,10-11H2,1-2H3
InChIKeyOGHNCTXZHWGXKY-UHFFFAOYSA-N
MW275.37 g/mol
LogP3.09
Rot. Bonds5

About N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide

N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 67511212) has the molecular formula C15H17NO2S and a molecular weight of 275.37 g/mol. Its IUPAC name is N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
PubChem CID67511212
Molecular FormulaC15H17NO2S
Molecular Weight275.37 g/mol
Exact Mass275.10
IUPAC NameN-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide
SMILESCc1ccc(OCC(=O)N(C)Cc2cccs2)cc1
InChIInChI=1S/C15H17NO2S/c1-12-5-7-13(8-6-12)18-11-15(17)16(2)10-14-4-3-9-19-14/h3-9H,10-11H2,1-2H3
InChIKeyOGHNCTXZHWGXKY-UHFFFAOYSA-N
XLogP3.09
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide (CID 67511212) is N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide is Cc1ccc(OCC(=O)N(C)Cc2cccs2)cc1.
What is the InChIKey of N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is OGHNCTXZHWGXKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2S/c1-12-5-7-13(8-6-12)18-11-15(17)16(2)10-14-4-3-9-19-14/h3-9H,10-11H2,1-2H3.
What are the key properties of N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide?
N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 275.37 g/mol, XLogP of 3.09, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-methylphenoxy)-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 67511212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).