1-ethyl-4-propan-2-ylidenepiperidine

C10H19N — CID 91053398

IUPAC1-ethyl-4-propan-2-ylidenepiperidine
SMILESCCN1CCC(=C(C)C)CC1
InChIInChI=1S/C10H19N/c1-4-11-7-5-10(6-8-11)9(2)3/h4-8H2,1-3H3
InChIKeyPTHZFGKRODFYMB-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.44
Rot. Bonds1

About 1-ethyl-4-propan-2-ylidenepiperidine

1-ethyl-4-propan-2-ylidenepiperidine (PubChem CID 91053398) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 1-ethyl-4-propan-2-ylidenepiperidine.

Molecular Properties

Compound Name1-ethyl-4-propan-2-ylidenepiperidine
PubChem CID91053398
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name1-ethyl-4-propan-2-ylidenepiperidine
SMILESCCN1CCC(=C(C)C)CC1
InChIInChI=1S/C10H19N/c1-4-11-7-5-10(6-8-11)9(2)3/h4-8H2,1-3H3
InChIKeyPTHZFGKRODFYMB-UHFFFAOYSA-N
XLogP2.44
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-propan-2-ylidenepiperidine?
The IUPAC name of 1-ethyl-4-propan-2-ylidenepiperidine (CID 91053398) is 1-ethyl-4-propan-2-ylidenepiperidine.
What is the SMILES notation for 1-ethyl-4-propan-2-ylidenepiperidine?
The canonical SMILES for 1-ethyl-4-propan-2-ylidenepiperidine is CCN1CCC(=C(C)C)CC1.
What is the InChIKey of 1-ethyl-4-propan-2-ylidenepiperidine?
The InChIKey is PTHZFGKRODFYMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-4-11-7-5-10(6-8-11)9(2)3/h4-8H2,1-3H3.
What are the key properties of 1-ethyl-4-propan-2-ylidenepiperidine?
1-ethyl-4-propan-2-ylidenepiperidine has a molecular weight of 153.27 g/mol, XLogP of 2.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-propan-2-ylidenepiperidine is sourced from PubChem (CID 91053398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).