N-(methoxymethyl)-1-methylpyrrolidin-2-imine

C7H14N2O — CID 91233615

IUPACN-(methoxymethyl)-1-methylpyrrolidin-2-imine
SMILESCOCN=C1CCCN1C
InChIInChI=1S/C7H14N2O/c1-9-5-3-4-7(9)8-6-10-2/h3-6H2,1-2H3
InChIKeyWYYSNGFUNAWBBL-UHFFFAOYSA-N
MW142.20 g/mol
LogP0.71
Rot. Bonds2

About N-(methoxymethyl)-1-methylpyrrolidin-2-imine

N-(methoxymethyl)-1-methylpyrrolidin-2-imine (PubChem CID 91233615) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N-(methoxymethyl)-1-methylpyrrolidin-2-imine.

Molecular Properties

Compound NameN-(methoxymethyl)-1-methylpyrrolidin-2-imine
PubChem CID91233615
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN-(methoxymethyl)-1-methylpyrrolidin-2-imine
SMILESCOCN=C1CCCN1C
InChIInChI=1S/C7H14N2O/c1-9-5-3-4-7(9)8-6-10-2/h3-6H2,1-2H3
InChIKeyWYYSNGFUNAWBBL-UHFFFAOYSA-N
XLogP0.71
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.71
H-Bond Donors ≤ 50
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 N-(methoxymethyl)-1-methylpyrrolidin-2-imine?
The IUPAC name of N-(methoxymethyl)-1-methylpyrrolidin-2-imine (CID 91233615) is N-(methoxymethyl)-1-methylpyrrolidin-2-imine.
What is the SMILES notation for N-(methoxymethyl)-1-methylpyrrolidin-2-imine?
The canonical SMILES for N-(methoxymethyl)-1-methylpyrrolidin-2-imine is COCN=C1CCCN1C.
What is the InChIKey of N-(methoxymethyl)-1-methylpyrrolidin-2-imine?
The InChIKey is WYYSNGFUNAWBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-9-5-3-4-7(9)8-6-10-2/h3-6H2,1-2H3.
What are the key properties of N-(methoxymethyl)-1-methylpyrrolidin-2-imine?
N-(methoxymethyl)-1-methylpyrrolidin-2-imine has a molecular weight of 142.20 g/mol, XLogP of 0.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(methoxymethyl)-1-methylpyrrolidin-2-imine is sourced from PubChem (CID 91233615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).