(2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide

C12H19NO2 — CID 10899853

IUPAC(2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide
SMILESC=CC1CC/C(=C/C(=O)N(CC)CC)O1
InChIInChI=1S/C12H19NO2/c1-4-10-7-8-11(15-10)9-12(14)13(5-2)6-3/h4,9-10H,1,5-8H2,2-3H3/b11-9-
InChIKeyGSFKUJRXRWCIEM-LUAWRHEFSA-N
MW209.29 g/mol
LogP2.10
Rot. Bonds4

About (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide

(2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide (PubChem CID 10899853) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide.

Molecular Properties

Compound Name(2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide
PubChem CID10899853
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name(2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide
SMILESC=CC1CC/C(=C/C(=O)N(CC)CC)O1
InChIInChI=1S/C12H19NO2/c1-4-10-7-8-11(15-10)9-12(14)13(5-2)6-3/h4,9-10H,1,5-8H2,2-3H3/b11-9-
InChIKeyGSFKUJRXRWCIEM-LUAWRHEFSA-N
XLogP2.10
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3E)-N,N-diethyl-4-tetrahydro-2-furanyl-3-butenamide
CID 24977898
(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)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide
CID 11446731
(2Z)-N,N-diethyl-2-(oxolan-2-ylidene)acetamide
CID 101028550
(2Z)-N-ethyl-N-methyl-2-(2-methyloxolan-3-ylidene)acetamide
CID 133619364
(E)-7-propan-2-yloxy-1-pyrrolidin-1-ylhept-2-en-1-one
CID 159542504
(E)-N-methyl-7-propan-2-yloxy-N-propylhept-2-enamide
CID 159542505
(2Z)-2-[(5R)-5-ethenyloxolan-2-ylidene]-N,N-dimethylacetamide
CID 177404361

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide?
The IUPAC name of (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide (CID 10899853) is (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide.
What is the SMILES notation for (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide?
The canonical SMILES for (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide is C=CC1CC/C(=C/C(=O)N(CC)CC)O1.
What is the InChIKey of (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide?
The InChIKey is GSFKUJRXRWCIEM-LUAWRHEFSA-N. The full InChI is InChI=1S/C12H19NO2/c1-4-10-7-8-11(15-10)9-12(14)13(5-2)6-3/h4,9-10H,1,5-8H2,2-3H3/b11-9-.
What are the key properties of (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide?
(2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide has a molecular weight of 209.29 g/mol, XLogP of 2.10, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(5-ethenyloxolan-2-ylidene)-N,N-diethylacetamide is sourced from PubChem (CID 10899853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).