4-ethyl-N-methylpyrrolidin-3-imine

C7H14N2 — CID 58961674

IUPAC4-ethyl-N-methylpyrrolidin-3-imine
SMILESCCC1CNC/C1=N\C
InChIInChI=1S/C7H14N2/c1-3-6-4-9-5-7(6)8-2/h6,9H,3-5H2,1-2H3/b8-7+
InChIKeyGSLGDLZJYMEAGI-BQYQJAHWSA-N
MW126.20 g/mol
LogP0.69
Rot. Bonds1

About 4-ethyl-N-methylpyrrolidin-3-imine

4-ethyl-N-methylpyrrolidin-3-imine (PubChem CID 58961674) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 4-ethyl-N-methylpyrrolidin-3-imine.

Molecular Properties

Compound Name4-ethyl-N-methylpyrrolidin-3-imine
PubChem CID58961674
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name4-ethyl-N-methylpyrrolidin-3-imine
SMILESCCC1CNC/C1=N\C
InChIInChI=1S/C7H14N2/c1-3-6-4-9-5-7(6)8-2/h6,9H,3-5H2,1-2H3/b8-7+
InChIKeyGSLGDLZJYMEAGI-BQYQJAHWSA-N
XLogP0.69
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4-Methyliminopyrrolidin-1-ium-3-yl)methylazanium
CID 20633763
(4-Methyliminopyrrolidin-3-yl)methanamine
CID 20633764
(E)-4-ethyl-N-methoxypyrrolidin-3-imine
CID 20697379
4-methyl-N-[[(3R)-pyrrolidin-3-yl]methyl]pentan-2-imine
CID 58010765
5-pyrrolidin-3-yl-4H-triazole
CID 58438948
N,4-dimethylpyrrolidin-3-imine
CID 59024451
(Z)-4-ethyl-N-methoxypyrrolidin-3-imine
CID 59971456
2,3,3a,4,5,6-Hexahydropyrrolo[2,3-c]pyrrole
CID 67794328
3,4,4a,5,6,7-hexahydro-2H-pyrrolo[3,4-b]pyridine
CID 70108552
4-Methylpyrrolidin-3-imine
CID 70149418
4-Ethanimidoylpyrrolidin-3-imine
CID 90898672
N-ethyl-4-methylpyrrolidin-3-imine
CID 90948336

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-methylpyrrolidin-3-imine?
The IUPAC name of 4-ethyl-N-methylpyrrolidin-3-imine (CID 58961674) is 4-ethyl-N-methylpyrrolidin-3-imine.
What is the SMILES notation for 4-ethyl-N-methylpyrrolidin-3-imine?
The canonical SMILES for 4-ethyl-N-methylpyrrolidin-3-imine is CCC1CNC/C1=N\C.
What is the InChIKey of 4-ethyl-N-methylpyrrolidin-3-imine?
The InChIKey is GSLGDLZJYMEAGI-BQYQJAHWSA-N. The full InChI is InChI=1S/C7H14N2/c1-3-6-4-9-5-7(6)8-2/h6,9H,3-5H2,1-2H3/b8-7+.
What are the key properties of 4-ethyl-N-methylpyrrolidin-3-imine?
4-ethyl-N-methylpyrrolidin-3-imine has a molecular weight of 126.20 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-methylpyrrolidin-3-imine is sourced from PubChem (CID 58961674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).