N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide

C10H14N2O2S — CID 134049303

IUPACN-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide
SMILESCNC(=O)CN(C)C(=O)Cc1cccs1
InChIInChI=1S/C10H14N2O2S/c1-11-9(13)7-12(2)10(14)6-8-4-3-5-15-8/h3-5H,6-7H2,1-2H3,(H,11,13)
InChIKeyNCECCRXULSWBDF-UHFFFAOYSA-N
MW226.30 g/mol
LogP0.50
Rot. Bonds4

About N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide

N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide (PubChem CID 134049303) has the molecular formula C10H14N2O2S and a molecular weight of 226.30 g/mol. Its IUPAC name is N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide
PubChem CID134049303
Molecular FormulaC10H14N2O2S
Molecular Weight226.30 g/mol
Exact Mass226.08
IUPAC NameN-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide
SMILESCNC(=O)CN(C)C(=O)Cc1cccs1
InChIInChI=1S/C10H14N2O2S/c1-11-9(13)7-12(2)10(14)6-8-4-3-5-15-8/h3-5H,6-7H2,1-2H3,(H,11,13)
InChIKeyNCECCRXULSWBDF-UHFFFAOYSA-N
XLogP0.50
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide (CID 134049303) is N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide is CNC(=O)CN(C)C(=O)Cc1cccs1.
What is the InChIKey of N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
The InChIKey is NCECCRXULSWBDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2S/c1-11-9(13)7-12(2)10(14)6-8-4-3-5-15-8/h3-5H,6-7H2,1-2H3,(H,11,13).
What are the key properties of N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide?
N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide has a molecular weight of 226.30 g/mol, XLogP of 0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(methylamino)-2-oxoethyl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 134049303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).