1-(2-methoxyethyl)pyrrolidin-2-imine

C7H14N2O — CID 43121979

IUPAC1-(2-methoxyethyl)pyrrolidin-2-imine
SMILES[H]/N=C1\CCCN1CCOC
InChIInChI=1S/C7H14N2O/c1-10-6-5-9-4-2-3-7(9)8/h8H,2-6H2,1H3/b8-7+
InChIKeyVOADDJUKWQVQOI-BQYQJAHWSA-N
MW142.20 g/mol
LogP0.71
Rot. Bonds3

About 1-(2-methoxyethyl)pyrrolidin-2-imine

1-(2-methoxyethyl)pyrrolidin-2-imine (PubChem CID 43121979) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-(2-methoxyethyl)pyrrolidin-2-imine.

Molecular Properties

Compound Name1-(2-methoxyethyl)pyrrolidin-2-imine
PubChem CID43121979
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name1-(2-methoxyethyl)pyrrolidin-2-imine
SMILES[H]/N=C1\CCCN1CCOC
InChIInChI=1S/C7H14N2O/c1-10-6-5-9-4-2-3-7(9)8/h8H,2-6H2,1H3/b8-7+
InChIKeyVOADDJUKWQVQOI-BQYQJAHWSA-N
XLogP0.71
TPSA36.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)pyrrolidin-2-imine?
The IUPAC name of 1-(2-methoxyethyl)pyrrolidin-2-imine (CID 43121979) is 1-(2-methoxyethyl)pyrrolidin-2-imine.
What is the SMILES notation for 1-(2-methoxyethyl)pyrrolidin-2-imine?
The canonical SMILES for 1-(2-methoxyethyl)pyrrolidin-2-imine is [H]/N=C1\CCCN1CCOC.
What is the InChIKey of 1-(2-methoxyethyl)pyrrolidin-2-imine?
The InChIKey is VOADDJUKWQVQOI-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H14N2O/c1-10-6-5-9-4-2-3-7(9)8/h8H,2-6H2,1H3/b8-7+.
What are the key properties of 1-(2-methoxyethyl)pyrrolidin-2-imine?
1-(2-methoxyethyl)pyrrolidin-2-imine has a molecular weight of 142.20 g/mol, XLogP of 0.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)pyrrolidin-2-imine is sourced from PubChem (CID 43121979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).