6-ethyl-N-methylpiperidin-3-imine

C8H16N2 — CID 123712407

IUPAC6-ethyl-N-methylpiperidin-3-imine
SMILESCCC1CC/C(=N\C)CN1
InChIInChI=1S/C8H16N2/c1-3-7-4-5-8(9-2)6-10-7/h7,10H,3-6H2,1-2H3/b9-8+
InChIKeyXUCSTQHTUDIQTA-CMDGGOBGSA-N
MW140.23 g/mol
LogP1.22
Rot. Bonds1

About 6-ethyl-N-methylpiperidin-3-imine

6-ethyl-N-methylpiperidin-3-imine (PubChem CID 123712407) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 6-ethyl-N-methylpiperidin-3-imine.

Molecular Properties

Compound Name6-ethyl-N-methylpiperidin-3-imine
PubChem CID123712407
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name6-ethyl-N-methylpiperidin-3-imine
SMILESCCC1CC/C(=N\C)CN1
InChIInChI=1S/C8H16N2/c1-3-7-4-5-8(9-2)6-10-7/h7,10H,3-6H2,1-2H3/b9-8+
InChIKeyXUCSTQHTUDIQTA-CMDGGOBGSA-N
XLogP1.22
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.22
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 6-ethyl-N-methylpiperidin-3-imine?
The IUPAC name of 6-ethyl-N-methylpiperidin-3-imine (CID 123712407) is 6-ethyl-N-methylpiperidin-3-imine.
What is the SMILES notation for 6-ethyl-N-methylpiperidin-3-imine?
The canonical SMILES for 6-ethyl-N-methylpiperidin-3-imine is CCC1CC/C(=N\C)CN1.
What is the InChIKey of 6-ethyl-N-methylpiperidin-3-imine?
The InChIKey is XUCSTQHTUDIQTA-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H16N2/c1-3-7-4-5-8(9-2)6-10-7/h7,10H,3-6H2,1-2H3/b9-8+.
What are the key properties of 6-ethyl-N-methylpiperidin-3-imine?
6-ethyl-N-methylpiperidin-3-imine has a molecular weight of 140.23 g/mol, XLogP of 1.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-methylpiperidin-3-imine is sourced from PubChem (CID 123712407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).