N-(2-ethylbut-1-enyl)acetamide

C8H15NO — CID 131985982

IUPACN-(2-ethylbut-1-enyl)acetamide
SMILESCCC(=CNC(C)=O)CC
InChIInChI=1S/C8H15NO/c1-4-8(5-2)6-9-7(3)10/h6H,4-5H2,1-3H3,(H,9,10)
InChIKeyNRRZGKOVVFCQNM-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.83
Rot. Bonds3

About N-(2-ethylbut-1-enyl)acetamide

N-(2-ethylbut-1-enyl)acetamide (PubChem CID 131985982) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is N-(2-ethylbut-1-enyl)acetamide.

Molecular Properties

Compound NameN-(2-ethylbut-1-enyl)acetamide
PubChem CID131985982
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC NameN-(2-ethylbut-1-enyl)acetamide
SMILESCCC(=CNC(C)=O)CC
InChIInChI=1S/C8H15NO/c1-4-8(5-2)6-9-7(3)10/h6H,4-5H2,1-3H3,(H,9,10)
InChIKeyNRRZGKOVVFCQNM-UHFFFAOYSA-N
XLogP1.83
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-(2-ethylbut-1-enyl)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-ethylbut-1-enyl)acetamide?
The IUPAC name of N-(2-ethylbut-1-enyl)acetamide (CID 131985982) is N-(2-ethylbut-1-enyl)acetamide.
What is the SMILES notation for N-(2-ethylbut-1-enyl)acetamide?
The canonical SMILES for N-(2-ethylbut-1-enyl)acetamide is CCC(=CNC(C)=O)CC.
What is the InChIKey of N-(2-ethylbut-1-enyl)acetamide?
The InChIKey is NRRZGKOVVFCQNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-4-8(5-2)6-9-7(3)10/h6H,4-5H2,1-3H3,(H,9,10).
What are the key properties of N-(2-ethylbut-1-enyl)acetamide?
N-(2-ethylbut-1-enyl)acetamide has a molecular weight of 141.21 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylbut-1-enyl)acetamide is sourced from PubChem (CID 131985982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).