4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine

C12H24N2 — CID 142616704

IUPAC4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine
SMILESCCCC1/C(=N/C)N(C)CCC1CC
InChIInChI=1S/C12H24N2/c1-5-7-11-10(6-2)8-9-14(4)12(11)13-3/h10-11H,5-9H2,1-4H3/b13-12-
InChIKeyOSPZTQUBTCJHHY-SEYXRHQNSA-N
MW196.34 g/mol
LogP2.79
Rot. Bonds3

About 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine

4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine (PubChem CID 142616704) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine.

Molecular Properties

Compound Name4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine
PubChem CID142616704
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine
SMILESCCCC1/C(=N/C)N(C)CCC1CC
InChIInChI=1S/C12H24N2/c1-5-7-11-10(6-2)8-9-14(4)12(11)13-3/h10-11H,5-9H2,1-4H3/b13-12-
InChIKeyOSPZTQUBTCJHHY-SEYXRHQNSA-N
XLogP2.79
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine?
The IUPAC name of 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine (CID 142616704) is 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine.
What is the SMILES notation for 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine?
The canonical SMILES for 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine is CCCC1/C(=N/C)N(C)CCC1CC.
What is the InChIKey of 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine?
The InChIKey is OSPZTQUBTCJHHY-SEYXRHQNSA-N. The full InChI is InChI=1S/C12H24N2/c1-5-7-11-10(6-2)8-9-14(4)12(11)13-3/h10-11H,5-9H2,1-4H3/b13-12-.
What are the key properties of 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine?
4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine has a molecular weight of 196.34 g/mol, XLogP of 2.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N,1-dimethyl-3-propylpiperidin-2-imine is sourced from PubChem (CID 142616704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).