(2Z)-2-(methoxymethylidene)pyrrolidine

C6H11NO — CID 70198486

IUPAC(2Z)-2-(methoxymethylidene)pyrrolidine
SMILESCO/C=C1/CCCN1
InChIInChI=1S/C6H11NO/c1-8-5-6-3-2-4-7-6/h5,7H,2-4H2,1H3/b6-5-
InChIKeyCTDJBPPZQRNZJC-WAYWQWQTSA-N
MW113.16 g/mol
LogP0.86
Rot. Bonds1

About (2Z)-2-(methoxymethylidene)pyrrolidine

(2Z)-2-(methoxymethylidene)pyrrolidine (PubChem CID 70198486) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is (2Z)-2-(methoxymethylidene)pyrrolidine.

Molecular Properties

Compound Name(2Z)-2-(methoxymethylidene)pyrrolidine
PubChem CID70198486
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name(2Z)-2-(methoxymethylidene)pyrrolidine
SMILESCO/C=C1/CCCN1
InChIInChI=1S/C6H11NO/c1-8-5-6-3-2-4-7-6/h5,7H,2-4H2,1H3/b6-5-
InChIKeyCTDJBPPZQRNZJC-WAYWQWQTSA-N
XLogP0.86
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2Z)-2-(methoxymethylidene)pyrrolidine?
The IUPAC name of (2Z)-2-(methoxymethylidene)pyrrolidine (CID 70198486) is (2Z)-2-(methoxymethylidene)pyrrolidine.
What is the SMILES notation for (2Z)-2-(methoxymethylidene)pyrrolidine?
The canonical SMILES for (2Z)-2-(methoxymethylidene)pyrrolidine is CO/C=C1/CCCN1.
What is the InChIKey of (2Z)-2-(methoxymethylidene)pyrrolidine?
The InChIKey is CTDJBPPZQRNZJC-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H11NO/c1-8-5-6-3-2-4-7-6/h5,7H,2-4H2,1H3/b6-5-.
What are the key properties of (2Z)-2-(methoxymethylidene)pyrrolidine?
(2Z)-2-(methoxymethylidene)pyrrolidine has a molecular weight of 113.16 g/mol, XLogP of 0.86, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-(methoxymethylidene)pyrrolidine is sourced from PubChem (CID 70198486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).