4-[(E)-but-2-enylidene]-1-methylpiperidine

C10H17N — CID 23579165

IUPAC4-[(E)-but-2-enylidene]-1-methylpiperidine
SMILESC/C=C/C=C1CCN(C)CC1
InChIInChI=1S/C10H17N/c1-3-4-5-10-6-8-11(2)9-7-10/h3-5H,6-9H2,1-2H3/b4-3+
InChIKeyLFUYDXLGEPOXCT-ONEGZZNKSA-N
MW151.25 g/mol
LogP2.21
Rot. Bonds1

About 4-[(E)-but-2-enylidene]-1-methylpiperidine

4-[(E)-but-2-enylidene]-1-methylpiperidine (PubChem CID 23579165) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is 4-[(E)-but-2-enylidene]-1-methylpiperidine.

Molecular Properties

Compound Name4-[(E)-but-2-enylidene]-1-methylpiperidine
PubChem CID23579165
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name4-[(E)-but-2-enylidene]-1-methylpiperidine
SMILESC/C=C/C=C1CCN(C)CC1
InChIInChI=1S/C10H17N/c1-3-4-5-10-6-8-11(2)9-7-10/h3-5H,6-9H2,1-2H3/b4-3+
InChIKeyLFUYDXLGEPOXCT-ONEGZZNKSA-N
XLogP2.21
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-but-2-enylidene]-1-methylpiperidine?
The IUPAC name of 4-[(E)-but-2-enylidene]-1-methylpiperidine (CID 23579165) is 4-[(E)-but-2-enylidene]-1-methylpiperidine.
What is the SMILES notation for 4-[(E)-but-2-enylidene]-1-methylpiperidine?
The canonical SMILES for 4-[(E)-but-2-enylidene]-1-methylpiperidine is C/C=C/C=C1CCN(C)CC1.
What is the InChIKey of 4-[(E)-but-2-enylidene]-1-methylpiperidine?
The InChIKey is LFUYDXLGEPOXCT-ONEGZZNKSA-N. The full InChI is InChI=1S/C10H17N/c1-3-4-5-10-6-8-11(2)9-7-10/h3-5H,6-9H2,1-2H3/b4-3+.
What are the key properties of 4-[(E)-but-2-enylidene]-1-methylpiperidine?
4-[(E)-but-2-enylidene]-1-methylpiperidine has a molecular weight of 151.25 g/mol, XLogP of 2.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-but-2-enylidene]-1-methylpiperidine is sourced from PubChem (CID 23579165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).