2-(ethoxymethyl)-4-methylidenepyrrolidine

C8H15NO — CID 176568560

IUPAC2-(ethoxymethyl)-4-methylidenepyrrolidine
SMILESC=C1CNC(COCC)C1
InChIInChI=1S/C8H15NO/c1-3-10-6-8-4-7(2)5-9-8/h8-9H,2-6H2,1H3
InChIKeyVRGUFPDKUDFMCL-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.94
Rot. Bonds3

About 2-(ethoxymethyl)-4-methylidenepyrrolidine

2-(ethoxymethyl)-4-methylidenepyrrolidine (PubChem CID 176568560) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-(ethoxymethyl)-4-methylidenepyrrolidine.

Molecular Properties

Compound Name2-(ethoxymethyl)-4-methylidenepyrrolidine
PubChem CID176568560
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-(ethoxymethyl)-4-methylidenepyrrolidine
SMILESC=C1CNC(COCC)C1
InChIInChI=1S/C8H15NO/c1-3-10-6-8-4-7(2)5-9-8/h8-9H,2-6H2,1H3
InChIKeyVRGUFPDKUDFMCL-UHFFFAOYSA-N
XLogP0.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2S)-4-(difluoromethylidene)-2-(methoxymethyl)pyrrolidine
CID 156243083
2-(Pent-4-enoxymethyl)pyrrolidine
CID 64313140
N-(2-methylidenebutyl)oxolan-3-amine
CID 80712888
2-(1-Methoxyethenyl)pyrrolidine
CID 91128615
[(2S)-4-methylidenepyrrolidin-2-yl]methyl acetate
CID 118994793
2-[(2S)-4-methylidenepyrrolidin-2-yl]-1,3-oxazolidine
CID 122551448
(2S)-2-(1-ethoxyethenyl)pyrrolidine
CID 126635209
2-[(2-Methylpropan-2-yl)oxymethyl]-4-propan-2-ylidenepyrrolidine
CID 132133663
(4Z)-4-ethylidene-2-(methoxymethyl)pyrrolidine
CID 139397543
(4S)-4-(2-methylprop-2-enyl)-1,3-oxazolidine
CID 141075303
2-(1-Cyclopentyloxyethenyl)pyrrolidin-1-ium
CID 143896460
(2S)-2-(1-methoxyethenyl)pyrrolidine;hydrochloride
CID 157183834

Frequently Asked Questions

What is the IUPAC name of 2-(ethoxymethyl)-4-methylidenepyrrolidine?
The IUPAC name of 2-(ethoxymethyl)-4-methylidenepyrrolidine (CID 176568560) is 2-(ethoxymethyl)-4-methylidenepyrrolidine.
What is the SMILES notation for 2-(ethoxymethyl)-4-methylidenepyrrolidine?
The canonical SMILES for 2-(ethoxymethyl)-4-methylidenepyrrolidine is C=C1CNC(COCC)C1.
What is the InChIKey of 2-(ethoxymethyl)-4-methylidenepyrrolidine?
The InChIKey is VRGUFPDKUDFMCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-3-10-6-8-4-7(2)5-9-8/h8-9H,2-6H2,1H3.
What are the key properties of 2-(ethoxymethyl)-4-methylidenepyrrolidine?
2-(ethoxymethyl)-4-methylidenepyrrolidine has a molecular weight of 141.21 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethoxymethyl)-4-methylidenepyrrolidine is sourced from PubChem (CID 176568560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).