(E)-5-(diethylamino)-2-methylpent-2-enamide

C10H20N2O — CID 22625439

IUPAC(E)-5-(diethylamino)-2-methylpent-2-enamide
SMILESCCN(CC)CC/C=C(\C)C(N)=O
InChIInChI=1S/C10H20N2O/c1-4-12(5-2)8-6-7-9(3)10(11)13/h7H,4-6,8H2,1-3H3,(H2,11,13)/b9-7+
InChIKeyGIAAGAMRYYDPBZ-VQHVLOKHSA-N
MW184.28 g/mol
LogP1.15
Rot. Bonds6

About (E)-5-(diethylamino)-2-methylpent-2-enamide

(E)-5-(diethylamino)-2-methylpent-2-enamide (PubChem CID 22625439) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (E)-5-(diethylamino)-2-methylpent-2-enamide.

Molecular Properties

Compound Name(E)-5-(diethylamino)-2-methylpent-2-enamide
PubChem CID22625439
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(E)-5-(diethylamino)-2-methylpent-2-enamide
SMILESCCN(CC)CC/C=C(\C)C(N)=O
InChIInChI=1S/C10H20N2O/c1-4-12(5-2)8-6-7-9(3)10(11)13/h7H,4-6,8H2,1-3H3,(H2,11,13)/b9-7+
InChIKeyGIAAGAMRYYDPBZ-VQHVLOKHSA-N
XLogP1.15
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (E)-5-(diethylamino)-2-methylpent-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)-5-(diethylamino)-2-methylpent-2-enamide?
The IUPAC name of (E)-5-(diethylamino)-2-methylpent-2-enamide (CID 22625439) is (E)-5-(diethylamino)-2-methylpent-2-enamide.
What is the SMILES notation for (E)-5-(diethylamino)-2-methylpent-2-enamide?
The canonical SMILES for (E)-5-(diethylamino)-2-methylpent-2-enamide is CCN(CC)CC/C=C(\C)C(N)=O.
What is the InChIKey of (E)-5-(diethylamino)-2-methylpent-2-enamide?
The InChIKey is GIAAGAMRYYDPBZ-VQHVLOKHSA-N. The full InChI is InChI=1S/C10H20N2O/c1-4-12(5-2)8-6-7-9(3)10(11)13/h7H,4-6,8H2,1-3H3,(H2,11,13)/b9-7+.
What are the key properties of (E)-5-(diethylamino)-2-methylpent-2-enamide?
(E)-5-(diethylamino)-2-methylpent-2-enamide has a molecular weight of 184.28 g/mol, XLogP of 1.15, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-(diethylamino)-2-methylpent-2-enamide is sourced from PubChem (CID 22625439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).