(3Z)-N-methyl-3-propylidenepiperidin-4-imine

C9H16N2 — CID 177021873

IUPAC(3Z)-N-methyl-3-propylidenepiperidin-4-imine
SMILESCC/C=C1/CNCC/C1=N\C
InChIInChI=1S/C9H16N2/c1-3-4-8-7-11-6-5-9(8)10-2/h4,11H,3,5-7H2,1-2H3/b8-4-,10-9+
InChIKeyOZUICENZARVLOH-CCAISUFFSA-N
MW152.24 g/mol
LogP1.39
Rot. Bonds1

About (3Z)-N-methyl-3-propylidenepiperidin-4-imine

(3Z)-N-methyl-3-propylidenepiperidin-4-imine (PubChem CID 177021873) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (3Z)-N-methyl-3-propylidenepiperidin-4-imine.

Molecular Properties

Compound Name(3Z)-N-methyl-3-propylidenepiperidin-4-imine
PubChem CID177021873
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(3Z)-N-methyl-3-propylidenepiperidin-4-imine
SMILESCC/C=C1/CNCC/C1=N\C
InChIInChI=1S/C9H16N2/c1-3-4-8-7-11-6-5-9(8)10-2/h4,11H,3,5-7H2,1-2H3/b8-4-,10-9+
InChIKeyOZUICENZARVLOH-CCAISUFFSA-N
XLogP1.39
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.39
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 (3Z)-N-methyl-3-propylidenepiperidin-4-imine?
The IUPAC name of (3Z)-N-methyl-3-propylidenepiperidin-4-imine (CID 177021873) is (3Z)-N-methyl-3-propylidenepiperidin-4-imine.
What is the SMILES notation for (3Z)-N-methyl-3-propylidenepiperidin-4-imine?
The canonical SMILES for (3Z)-N-methyl-3-propylidenepiperidin-4-imine is CC/C=C1/CNCC/C1=N\C.
What is the InChIKey of (3Z)-N-methyl-3-propylidenepiperidin-4-imine?
The InChIKey is OZUICENZARVLOH-CCAISUFFSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-4-8-7-11-6-5-9(8)10-2/h4,11H,3,5-7H2,1-2H3/b8-4-,10-9+.
What are the key properties of (3Z)-N-methyl-3-propylidenepiperidin-4-imine?
(3Z)-N-methyl-3-propylidenepiperidin-4-imine has a molecular weight of 152.24 g/mol, XLogP of 1.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N-methyl-3-propylidenepiperidin-4-imine is sourced from PubChem (CID 177021873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).