methoxymethane;pyrrolidine-3-carbaldehyde

C7H15NO2 — CID 144633134

IUPACmethoxymethane;pyrrolidine-3-carbaldehyde
SMILESCOC.O=CC1CCNC1
InChIInChI=1S/C5H9NO.C2H6O/c7-4-5-1-2-6-3-5;1-3-2/h4-6H,1-3H2;1-2H3
InChIKeyQAGLHPNQVQKBBW-UHFFFAOYSA-N
MW145.20 g/mol
LogP0.06
Rot. Bonds1

About methoxymethane;pyrrolidine-3-carbaldehyde

methoxymethane;pyrrolidine-3-carbaldehyde (PubChem CID 144633134) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is methoxymethane;pyrrolidine-3-carbaldehyde.

Molecular Properties

Compound Namemethoxymethane;pyrrolidine-3-carbaldehyde
PubChem CID144633134
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Namemethoxymethane;pyrrolidine-3-carbaldehyde
SMILESCOC.O=CC1CCNC1
InChIInChI=1S/C5H9NO.C2H6O/c7-4-5-1-2-6-3-5;1-3-2/h4-6H,1-3H2;1-2H3
InChIKeyQAGLHPNQVQKBBW-UHFFFAOYSA-N
XLogP0.06
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 50.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methoxymethane;pyrrolidine-3-carbaldehyde?
The IUPAC name of methoxymethane;pyrrolidine-3-carbaldehyde (CID 144633134) is methoxymethane;pyrrolidine-3-carbaldehyde.
What is the SMILES notation for methoxymethane;pyrrolidine-3-carbaldehyde?
The canonical SMILES for methoxymethane;pyrrolidine-3-carbaldehyde is COC.O=CC1CCNC1.
What is the InChIKey of methoxymethane;pyrrolidine-3-carbaldehyde?
The InChIKey is QAGLHPNQVQKBBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO.C2H6O/c7-4-5-1-2-6-3-5;1-3-2/h4-6H,1-3H2;1-2H3.
What are the key properties of methoxymethane;pyrrolidine-3-carbaldehyde?
methoxymethane;pyrrolidine-3-carbaldehyde has a molecular weight of 145.20 g/mol, XLogP of 0.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxymethane;pyrrolidine-3-carbaldehyde is sourced from PubChem (CID 144633134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).