N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide

C11H15NOS — CID 115628042

IUPACN-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide
SMILESC/C=C/CCNC(=O)Cc1ccsc1
InChIInChI=1S/C11H15NOS/c1-2-3-4-6-12-11(13)8-10-5-7-14-9-10/h2-3,5,7,9H,4,6,8H2,1H3,(H,12,13)/b3-2+
InChIKeyNSXUHJBPWABUOD-NSCUHMNNSA-N
MW209.31 g/mol
LogP2.37
Rot. Bonds5

About N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide

N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide (PubChem CID 115628042) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide.

Molecular Properties

Compound NameN-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide
PubChem CID115628042
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC NameN-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide
SMILESC/C=C/CCNC(=O)Cc1ccsc1
InChIInChI=1S/C11H15NOS/c1-2-3-4-6-12-11(13)8-10-5-7-14-9-10/h2-3,5,7,9H,4,6,8H2,1H3,(H,12,13)/b3-2+
InChIKeyNSXUHJBPWABUOD-NSCUHMNNSA-N
XLogP2.37
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(6-bromohexyl)-2-thiophen-3-ylacetamide
CID 107847604
N-(2-amino-2-methylpropyl)-2-thiophen-3-ylacetamide;hydrochloride
CID 119628292
N-(2-hydroxy-2-methylpropyl)-2-thiophen-3-ylacetamide
CID 65109995
N-[(E)-pent-3-enyl]-2-(5-thiophen-3-yltetrazol-2-yl)acetamide
CID 115628398
2-hydroxy-4-[(2-thiophen-3-ylacetyl)amino]butanoic acid
CID 107831984
N-[2-[(2-thiophen-3-ylacetyl)amino]ethyl]cyclopropanecarboxamide
CID 47102251
N-(5-bromo-4-methylpentyl)-2-thiophen-3-ylacetamide
CID 106158024
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-thiophen-3-ylacetamide
CID 43229184
4-methyl-5-[(2-thiophen-3-ylacetyl)amino]pentanoic acid
CID 82010120
N-(2,3-dihydroxy-2-methylpropyl)-2-thiophen-3-ylacetamide
CID 66170415
N-(2-amino-2-ethylbutyl)-2-thiophen-3-ylacetamide;hydrochloride
CID 119641880
N-(2-pyridin-2-ylethyl)-2-thiophen-3-ylacetamide
CID 32623668

Frequently Asked Questions

What is the IUPAC name of N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide?
The IUPAC name of N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide (CID 115628042) is N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide.
What is the SMILES notation for N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide?
The canonical SMILES for N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide is C/C=C/CCNC(=O)Cc1ccsc1.
What is the InChIKey of N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide?
The InChIKey is NSXUHJBPWABUOD-NSCUHMNNSA-N. The full InChI is InChI=1S/C11H15NOS/c1-2-3-4-6-12-11(13)8-10-5-7-14-9-10/h2-3,5,7,9H,4,6,8H2,1H3,(H,12,13)/b3-2+.
What are the key properties of N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide?
N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide has a molecular weight of 209.31 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-pent-3-enyl]-2-thiophen-3-ylacetamide is sourced from PubChem (CID 115628042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).