N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide

C8H9N5OS — CID 146134384

IUPACN-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide
SMILESCNC(=O)Cn1nnnc1-c1ccsc1
InChIInChI=1S/C8H9N5OS/c1-9-7(14)4-13-8(10-11-12-13)6-2-3-15-5-6/h2-3,5H,4H2,1H3,(H,9,14)
InChIKeyDUQXNJIWESMGBF-UHFFFAOYSA-N
MW223.26 g/mol
LogP0.15
Rot. Bonds3

About N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide

N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide (PubChem CID 146134384) has the molecular formula C8H9N5OS and a molecular weight of 223.26 g/mol. Its IUPAC name is N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide.

Molecular Properties

Compound NameN-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide
PubChem CID146134384
Molecular FormulaC8H9N5OS
Molecular Weight223.26 g/mol
Exact Mass223.05
IUPAC NameN-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide
SMILESCNC(=O)Cn1nnnc1-c1ccsc1
InChIInChI=1S/C8H9N5OS/c1-9-7(14)4-13-8(10-11-12-13)6-2-3-15-5-6/h2-3,5H,4H2,1H3,(H,9,14)
InChIKeyDUQXNJIWESMGBF-UHFFFAOYSA-N
XLogP0.15
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.26
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)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-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide?
The IUPAC name of N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide (CID 146134384) is N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide.
What is the SMILES notation for N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide?
The canonical SMILES for N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide is CNC(=O)Cn1nnnc1-c1ccsc1.
What is the InChIKey of N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide?
The InChIKey is DUQXNJIWESMGBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5OS/c1-9-7(14)4-13-8(10-11-12-13)6-2-3-15-5-6/h2-3,5H,4H2,1H3,(H,9,14).
What are the key properties of N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide?
N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide has a molecular weight of 223.26 g/mol, XLogP of 0.15, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(5-thiophen-3-yltetrazol-1-yl)acetamide is sourced from PubChem (CID 146134384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).