(E)-2-ethyl-N,N-dimethylbut-2-enamide

C8H15NO — CID 143612571

IUPAC(E)-2-ethyl-N,N-dimethylbut-2-enamide
SMILESC/C=C(\CC)C(=O)N(C)C
InChIInChI=1S/C8H15NO/c1-5-7(6-2)8(10)9(3)4/h5H,6H2,1-4H3/b7-5+
InChIKeyCYQVXAHWTVSUCQ-FNORWQNLSA-N
MW141.21 g/mol
LogP1.43
Rot. Bonds2

About (E)-2-ethyl-N,N-dimethylbut-2-enamide

(E)-2-ethyl-N,N-dimethylbut-2-enamide (PubChem CID 143612571) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (E)-2-ethyl-N,N-dimethylbut-2-enamide.

Molecular Properties

Compound Name(E)-2-ethyl-N,N-dimethylbut-2-enamide
PubChem CID143612571
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(E)-2-ethyl-N,N-dimethylbut-2-enamide
SMILESC/C=C(\CC)C(=O)N(C)C
InChIInChI=1S/C8H15NO/c1-5-7(6-2)8(10)9(3)4/h5H,6H2,1-4H3/b7-5+
InChIKeyCYQVXAHWTVSUCQ-FNORWQNLSA-N
XLogP1.43
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (E)-2-ethyl-N,N-dimethylbut-2-enamide 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 (E)-2-ethyl-N,N-dimethylbut-2-enamide?
The IUPAC name of (E)-2-ethyl-N,N-dimethylbut-2-enamide (CID 143612571) is (E)-2-ethyl-N,N-dimethylbut-2-enamide.
What is the SMILES notation for (E)-2-ethyl-N,N-dimethylbut-2-enamide?
The canonical SMILES for (E)-2-ethyl-N,N-dimethylbut-2-enamide is C/C=C(\CC)C(=O)N(C)C.
What is the InChIKey of (E)-2-ethyl-N,N-dimethylbut-2-enamide?
The InChIKey is CYQVXAHWTVSUCQ-FNORWQNLSA-N. The full InChI is InChI=1S/C8H15NO/c1-5-7(6-2)8(10)9(3)4/h5H,6H2,1-4H3/b7-5+.
What are the key properties of (E)-2-ethyl-N,N-dimethylbut-2-enamide?
(E)-2-ethyl-N,N-dimethylbut-2-enamide has a molecular weight of 141.21 g/mol, XLogP of 1.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-ethyl-N,N-dimethylbut-2-enamide is sourced from PubChem (CID 143612571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).