2-piperidin-4-ylprop-2-en-1-imine

C8H14N2 — CID 143928248

IUPAC2-piperidin-4-ylprop-2-en-1-imine
SMILES[H]/N=C/C(=C)C1CCNCC1
InChIInChI=1S/C8H14N2/c1-7(6-9)8-2-4-10-5-3-8/h6,8-10H,1-5H2/b9-6+
InChIKeyFLFPHHHUPRYVJK-RMKNXTFCSA-N
MW138.21 g/mol
LogP1.19
Rot. Bonds2

About 2-piperidin-4-ylprop-2-en-1-imine

2-piperidin-4-ylprop-2-en-1-imine (PubChem CID 143928248) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 2-piperidin-4-ylprop-2-en-1-imine.

Molecular Properties

Compound Name2-piperidin-4-ylprop-2-en-1-imine
PubChem CID143928248
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name2-piperidin-4-ylprop-2-en-1-imine
SMILES[H]/N=C/C(=C)C1CCNCC1
InChIInChI=1S/C8H14N2/c1-7(6-9)8-2-4-10-5-3-8/h6,8-10H,1-5H2/b9-6+
InChIKeyFLFPHHHUPRYVJK-RMKNXTFCSA-N
XLogP1.19
TPSA35.88 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.19
H-Bond Donors ≤ 52
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 2-piperidin-4-ylprop-2-en-1-imine?
The IUPAC name of 2-piperidin-4-ylprop-2-en-1-imine (CID 143928248) is 2-piperidin-4-ylprop-2-en-1-imine.
What is the SMILES notation for 2-piperidin-4-ylprop-2-en-1-imine?
The canonical SMILES for 2-piperidin-4-ylprop-2-en-1-imine is [H]/N=C/C(=C)C1CCNCC1.
What is the InChIKey of 2-piperidin-4-ylprop-2-en-1-imine?
The InChIKey is FLFPHHHUPRYVJK-RMKNXTFCSA-N. The full InChI is InChI=1S/C8H14N2/c1-7(6-9)8-2-4-10-5-3-8/h6,8-10H,1-5H2/b9-6+.
What are the key properties of 2-piperidin-4-ylprop-2-en-1-imine?
2-piperidin-4-ylprop-2-en-1-imine has a molecular weight of 138.21 g/mol, XLogP of 1.19, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperidin-4-ylprop-2-en-1-imine is sourced from PubChem (CID 143928248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).