1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine

C17H32N2 — CID 158767420

IUPAC1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine
SMILESC=C1CCN(C(C)C)CC1.C=C1CCN(CC)CC1
InChIInChI=1S/C9H17N.C8H15N/c1-8(2)10-6-4-9(3)5-7-10;1-3-9-6-4-8(2)5-7-9/h8H,3-7H2,1-2H3;2-7H2,1H3
InChIKeyIPKYFFRWFPKGDP-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.71
Rot. Bonds2

About 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine

1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine (PubChem CID 158767420) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine
PubChem CID158767420
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine
SMILESC=C1CCN(C(C)C)CC1.C=C1CCN(CC)CC1
InChIInChI=1S/C9H17N.C8H15N/c1-8(2)10-6-4-9(3)5-7-10;1-3-9-6-4-8(2)5-7-9/h8H,3-7H2,1-2H3;2-7H2,1H3
InChIKeyIPKYFFRWFPKGDP-UHFFFAOYSA-N
XLogP3.71
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine?
The IUPAC name of 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine (CID 158767420) is 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine.
What is the SMILES notation for 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine?
The canonical SMILES for 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine is C=C1CCN(C(C)C)CC1.C=C1CCN(CC)CC1.
What is the InChIKey of 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine?
The InChIKey is IPKYFFRWFPKGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N.C8H15N/c1-8(2)10-6-4-9(3)5-7-10;1-3-9-6-4-8(2)5-7-9/h8H,3-7H2,1-2H3;2-7H2,1H3.
What are the key properties of 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine?
1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine has a molecular weight of 264.46 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-methylidenepiperidine;4-methylidene-1-propan-2-ylpiperidine is sourced from PubChem (CID 158767420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).