N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide

C12H19NO2S — CID 70146312

IUPACN-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide
SMILESCOC(C)CN(C(C)=O)c1c(C)csc1C
InChIInChI=1S/C12H19NO2S/c1-8-7-16-10(3)12(8)13(11(4)14)6-9(2)15-5/h7,9H,6H2,1-5H3
InChIKeyKUMSMUFVYRIBHS-UHFFFAOYSA-N
MW241.36 g/mol
LogP2.75
Rot. Bonds4

About N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide

N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide (PubChem CID 70146312) has the molecular formula C12H19NO2S and a molecular weight of 241.36 g/mol. Its IUPAC name is N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide.

Molecular Properties

Compound NameN-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide
PubChem CID70146312
Molecular FormulaC12H19NO2S
Molecular Weight241.36 g/mol
Exact Mass241.11
IUPAC NameN-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide
SMILESCOC(C)CN(C(C)=O)c1c(C)csc1C
InChIInChI=1S/C12H19NO2S/c1-8-7-16-10(3)12(8)13(11(4)14)6-9(2)15-5/h7,9H,6H2,1-5H3
InChIKeyKUMSMUFVYRIBHS-UHFFFAOYSA-N
XLogP2.75
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide?
The IUPAC name of N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide (CID 70146312) is N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide.
What is the SMILES notation for N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide?
The canonical SMILES for N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide is COC(C)CN(C(C)=O)c1c(C)csc1C.
What is the InChIKey of N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide?
The InChIKey is KUMSMUFVYRIBHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2S/c1-8-7-16-10(3)12(8)13(11(4)14)6-9(2)15-5/h7,9H,6H2,1-5H3.
What are the key properties of N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide?
N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide has a molecular weight of 241.36 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylthiophen-3-yl)-N-(2-methoxypropyl)acetamide is sourced from PubChem (CID 70146312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).