1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine

C13H24N2 — CID 167255585

IUPAC1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine
SMILESCCC/C=C\N=C(/C)N1CCC(C)CC1
InChIInChI=1S/C13H24N2/c1-4-5-6-9-14-13(3)15-10-7-12(2)8-11-15/h6,9,12H,4-5,7-8,10-11H2,1-3H3/b9-6-,14-13+
InChIKeyDGFKQPQNGRWZQZ-VFMLYFKRSA-N
MW208.35 g/mol
LogP3.45
Rot. Bonds3

About 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine

1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine (PubChem CID 167255585) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine.

Molecular Properties

Compound Name1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine
PubChem CID167255585
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine
SMILESCCC/C=C\N=C(/C)N1CCC(C)CC1
InChIInChI=1S/C13H24N2/c1-4-5-6-9-14-13(3)15-10-7-12(2)8-11-15/h6,9,12H,4-5,7-8,10-11H2,1-3H3/b9-6-,14-13+
InChIKeyDGFKQPQNGRWZQZ-VFMLYFKRSA-N
XLogP3.45
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine?
The IUPAC name of 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine (CID 167255585) is 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine.
What is the SMILES notation for 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine?
The canonical SMILES for 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine is CCC/C=C\N=C(/C)N1CCC(C)CC1.
What is the InChIKey of 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine?
The InChIKey is DGFKQPQNGRWZQZ-VFMLYFKRSA-N. The full InChI is InChI=1S/C13H24N2/c1-4-5-6-9-14-13(3)15-10-7-12(2)8-11-15/h6,9,12H,4-5,7-8,10-11H2,1-3H3/b9-6-,14-13+.
What are the key properties of 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine?
1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine has a molecular weight of 208.35 g/mol, XLogP of 3.45, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperidin-1-yl)-N-[(Z)-pent-1-enyl]ethanimine is sourced from PubChem (CID 167255585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).