(2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide

C10H17NO2 — CID 11446731

IUPAC(2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide
SMILESCCN(CC)C(=O)/C=C1\CCCO1
InChIInChI=1S/C10H17NO2/c1-3-11(4-2)10(12)8-9-6-5-7-13-9/h8H,3-7H2,1-2H3/b9-8+
InChIKeyGFXYVIVXLKEUJK-CMDGGOBGSA-N
MW183.25 g/mol
LogP1.55
Rot. Bonds3

About (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide

(2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide (PubChem CID 11446731) has the molecular formula C10H17NO2 and a molecular weight of 183.25 g/mol. Its IUPAC name is (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide.

Molecular Properties

Compound Name(2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide
PubChem CID11446731
Molecular FormulaC10H17NO2
Molecular Weight183.25 g/mol
Exact Mass183.13
IUPAC Name(2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide
SMILESCCN(CC)C(=O)/C=C1\CCCO1
InChIInChI=1S/C10H17NO2/c1-3-11(4-2)10(12)8-9-6-5-7-13-9/h8H,3-7H2,1-2H3/b9-8+
InChIKeyGFXYVIVXLKEUJK-CMDGGOBGSA-N
XLogP1.55
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2E)-1-morpholin-4-yl-2-(oxolan-2-ylidene)ethanone
CID 101440720
(2E)-2-(5-methyloxolan-2-ylidene)-1-morpholin-4-ylethanone
CID 101440721
(2E)-N,N-diethyl-2-(5-methyloxolan-2-ylidene)acetamide
CID 134855897
(2E)-2-(5,5-dimethyloxolan-2-ylidene)-N,N-diethylacetamide
CID 134975210
(2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide
CID 10899853
(2Z)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide
CID 101028550
(E)-N-[(E)-6-hydroxyhex-2-enyl]-3-methoxy-N-methylbut-2-enamide
CID 121003794

Frequently Asked Questions

What is the IUPAC name of (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide?
The IUPAC name of (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide (CID 11446731) is (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide.
What is the SMILES notation for (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide?
The canonical SMILES for (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide is CCN(CC)C(=O)/C=C1\CCCO1.
What is the InChIKey of (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide?
The InChIKey is GFXYVIVXLKEUJK-CMDGGOBGSA-N. The full InChI is InChI=1S/C10H17NO2/c1-3-11(4-2)10(12)8-9-6-5-7-13-9/h8H,3-7H2,1-2H3/b9-8+.
What are the key properties of (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide?
(2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide has a molecular weight of 183.25 g/mol, XLogP of 1.55, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide is sourced from PubChem (CID 11446731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).