(E)-N,N-diethyl-2,3-dimethylpent-2-enamide

C11H21NO — CID 102303657

IUPAC(E)-N,N-diethyl-2,3-dimethylpent-2-enamide
SMILESCC/C(C)=C(\C)C(=O)N(CC)CC
InChIInChI=1S/C11H21NO/c1-6-9(4)10(5)11(13)12(7-2)8-3/h6-8H2,1-5H3/b10-9+
InChIKeyZQCCKFLBDMJJKK-MDZDMXLPSA-N
MW183.29 g/mol
LogP2.60
Rot. Bonds4

About (E)-N,N-diethyl-2,3-dimethylpent-2-enamide

(E)-N,N-diethyl-2,3-dimethylpent-2-enamide (PubChem CID 102303657) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is (E)-N,N-diethyl-2,3-dimethylpent-2-enamide.

Molecular Properties

Compound Name(E)-N,N-diethyl-2,3-dimethylpent-2-enamide
PubChem CID102303657
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name(E)-N,N-diethyl-2,3-dimethylpent-2-enamide
SMILESCC/C(C)=C(\C)C(=O)N(CC)CC
InChIInChI=1S/C11H21NO/c1-6-9(4)10(5)11(13)12(7-2)8-3/h6-8H2,1-5H3/b10-9+
InChIKeyZQCCKFLBDMJJKK-MDZDMXLPSA-N
XLogP2.60
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (E)-N,N-diethyl-2,3-dimethylpent-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)-N,N-diethyl-2,3-dimethylpent-2-enamide?
The IUPAC name of (E)-N,N-diethyl-2,3-dimethylpent-2-enamide (CID 102303657) is (E)-N,N-diethyl-2,3-dimethylpent-2-enamide.
What is the SMILES notation for (E)-N,N-diethyl-2,3-dimethylpent-2-enamide?
The canonical SMILES for (E)-N,N-diethyl-2,3-dimethylpent-2-enamide is CC/C(C)=C(\C)C(=O)N(CC)CC.
What is the InChIKey of (E)-N,N-diethyl-2,3-dimethylpent-2-enamide?
The InChIKey is ZQCCKFLBDMJJKK-MDZDMXLPSA-N. The full InChI is InChI=1S/C11H21NO/c1-6-9(4)10(5)11(13)12(7-2)8-3/h6-8H2,1-5H3/b10-9+.
What are the key properties of (E)-N,N-diethyl-2,3-dimethylpent-2-enamide?
(E)-N,N-diethyl-2,3-dimethylpent-2-enamide has a molecular weight of 183.29 g/mol, XLogP of 2.60, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-diethyl-2,3-dimethylpent-2-enamide is sourced from PubChem (CID 102303657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).