N-(5-methylthiophene-2-carboximidoyl)acetamide

C8H10N2OS — CID 174077061

IUPACN-(5-methylthiophene-2-carboximidoyl)acetamide
SMILES[H]/N=C(\NC(C)=O)c1ccc(C)s1
InChIInChI=1S/C8H10N2OS/c1-5-3-4-7(12-5)8(9)10-6(2)11/h3-4H,1-2H3,(H2,9,10,11)
InChIKeyCTYNYQMLMACIRF-UHFFFAOYSA-N
MW182.25 g/mol
LogP1.52
Rot. Bonds1

About N-(5-methylthiophene-2-carboximidoyl)acetamide

N-(5-methylthiophene-2-carboximidoyl)acetamide (PubChem CID 174077061) has the molecular formula C8H10N2OS and a molecular weight of 182.25 g/mol. Its IUPAC name is N-(5-methylthiophene-2-carboximidoyl)acetamide.

Molecular Properties

Compound NameN-(5-methylthiophene-2-carboximidoyl)acetamide
PubChem CID174077061
Molecular FormulaC8H10N2OS
Molecular Weight182.25 g/mol
Exact Mass182.05
IUPAC NameN-(5-methylthiophene-2-carboximidoyl)acetamide
SMILES[H]/N=C(\NC(C)=O)c1ccc(C)s1
InChIInChI=1S/C8H10N2OS/c1-5-3-4-7(12-5)8(9)10-6(2)11/h3-4H,1-2H3,(H2,9,10,11)
InChIKeyCTYNYQMLMACIRF-UHFFFAOYSA-N
XLogP1.52
TPSA52.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.25
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N-(5-methylthiophene-2-carboximidoyl)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-(5-methylthiophene-2-carboximidoyl)acetamide?
The IUPAC name of N-(5-methylthiophene-2-carboximidoyl)acetamide (CID 174077061) is N-(5-methylthiophene-2-carboximidoyl)acetamide.
What is the SMILES notation for N-(5-methylthiophene-2-carboximidoyl)acetamide?
The canonical SMILES for N-(5-methylthiophene-2-carboximidoyl)acetamide is [H]/N=C(\NC(C)=O)c1ccc(C)s1.
What is the InChIKey of N-(5-methylthiophene-2-carboximidoyl)acetamide?
The InChIKey is CTYNYQMLMACIRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2OS/c1-5-3-4-7(12-5)8(9)10-6(2)11/h3-4H,1-2H3,(H2,9,10,11).
What are the key properties of N-(5-methylthiophene-2-carboximidoyl)acetamide?
N-(5-methylthiophene-2-carboximidoyl)acetamide has a molecular weight of 182.25 g/mol, XLogP of 1.52, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylthiophene-2-carboximidoyl)acetamide is sourced from PubChem (CID 174077061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).