N-(2-aminoethyl)-N-but-1-en-2-ylacetamide

C8H16N2O — CID 142823488

IUPACN-(2-aminoethyl)-N-but-1-en-2-ylacetamide
SMILESC=C(CC)N(CCN)C(C)=O
InChIInChI=1S/C8H16N2O/c1-4-7(2)10(6-5-9)8(3)11/h2,4-6,9H2,1,3H3
InChIKeyKWKJBMYRDOIZMM-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.72
Rot. Bonds4

About N-(2-aminoethyl)-N-but-1-en-2-ylacetamide

N-(2-aminoethyl)-N-but-1-en-2-ylacetamide (PubChem CID 142823488) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-but-1-en-2-ylacetamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-but-1-en-2-ylacetamide
PubChem CID142823488
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-(2-aminoethyl)-N-but-1-en-2-ylacetamide
SMILESC=C(CC)N(CCN)C(C)=O
InChIInChI=1S/C8H16N2O/c1-4-7(2)10(6-5-9)8(3)11/h2,4-6,9H2,1,3H3
InChIKeyKWKJBMYRDOIZMM-UHFFFAOYSA-N
XLogP0.72
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-aminoethyl)-N-but-1-en-2-ylacetamide 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-aminoethyl)-N-but-1-en-2-ylacetamide?
The IUPAC name of N-(2-aminoethyl)-N-but-1-en-2-ylacetamide (CID 142823488) is N-(2-aminoethyl)-N-but-1-en-2-ylacetamide.
What is the SMILES notation for N-(2-aminoethyl)-N-but-1-en-2-ylacetamide?
The canonical SMILES for N-(2-aminoethyl)-N-but-1-en-2-ylacetamide is C=C(CC)N(CCN)C(C)=O.
What is the InChIKey of N-(2-aminoethyl)-N-but-1-en-2-ylacetamide?
The InChIKey is KWKJBMYRDOIZMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-4-7(2)10(6-5-9)8(3)11/h2,4-6,9H2,1,3H3.
What are the key properties of N-(2-aminoethyl)-N-but-1-en-2-ylacetamide?
N-(2-aminoethyl)-N-but-1-en-2-ylacetamide has a molecular weight of 156.23 g/mol, XLogP of 0.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-but-1-en-2-ylacetamide is sourced from PubChem (CID 142823488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).