2-thiophen-3-ylbutanamide

C8H11NOS — CID 3056614

IUPAC2-thiophen-3-ylbutanamide
SMILESCCC(C(N)=O)c1ccsc1
InChIInChI=1S/C8H11NOS/c1-2-7(8(9)10)6-3-4-11-5-6/h3-5,7H,2H2,1H3,(H2,9,10)
InChIKeyHPMAYLPTWNTYLC-UHFFFAOYSA-N
MW169.25 g/mol
LogP1.73
Rot. Bonds3

About 2-thiophen-3-ylbutanamide

2-thiophen-3-ylbutanamide (PubChem CID 3056614) has the molecular formula C8H11NOS and a molecular weight of 169.25 g/mol. Its IUPAC name is 2-thiophen-3-ylbutanamide.

Molecular Properties

Compound Name2-thiophen-3-ylbutanamide
PubChem CID3056614
Molecular FormulaC8H11NOS
Molecular Weight169.25 g/mol
Exact Mass169.06
IUPAC Name2-thiophen-3-ylbutanamide
SMILESCCC(C(N)=O)c1ccsc1
InChIInChI=1S/C8H11NOS/c1-2-7(8(9)10)6-3-4-11-5-6/h3-5,7H,2H2,1H3,(H2,9,10)
InChIKeyHPMAYLPTWNTYLC-UHFFFAOYSA-N
XLogP1.73
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.25
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-thiophen-3-ylbutanamide 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 2-thiophen-3-ylbutanamide?
The IUPAC name of 2-thiophen-3-ylbutanamide (CID 3056614) is 2-thiophen-3-ylbutanamide.
What is the SMILES notation for 2-thiophen-3-ylbutanamide?
The canonical SMILES for 2-thiophen-3-ylbutanamide is CCC(C(N)=O)c1ccsc1.
What is the InChIKey of 2-thiophen-3-ylbutanamide?
The InChIKey is HPMAYLPTWNTYLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NOS/c1-2-7(8(9)10)6-3-4-11-5-6/h3-5,7H,2H2,1H3,(H2,9,10).
What are the key properties of 2-thiophen-3-ylbutanamide?
2-thiophen-3-ylbutanamide has a molecular weight of 169.25 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-3-ylbutanamide is sourced from PubChem (CID 3056614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).