4-ethenyl-1-methyl-4-propoxypiperidine

C11H21NO — CID 143860830

IUPAC4-ethenyl-1-methyl-4-propoxypiperidine
SMILESC=CC1(OCCC)CCN(C)CC1
InChIInChI=1S/C11H21NO/c1-4-10-13-11(5-2)6-8-12(3)9-7-11/h5H,2,4,6-10H2,1,3H3
InChIKeyKTSYUYSNGWRZQQ-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.06
Rot. Bonds4

About 4-ethenyl-1-methyl-4-propoxypiperidine

4-ethenyl-1-methyl-4-propoxypiperidine (PubChem CID 143860830) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-ethenyl-1-methyl-4-propoxypiperidine.

Molecular Properties

Compound Name4-ethenyl-1-methyl-4-propoxypiperidine
PubChem CID143860830
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-ethenyl-1-methyl-4-propoxypiperidine
SMILESC=CC1(OCCC)CCN(C)CC1
InChIInChI=1S/C11H21NO/c1-4-10-13-11(5-2)6-8-12(3)9-7-11/h5H,2,4,6-10H2,1,3H3
InChIKeyKTSYUYSNGWRZQQ-UHFFFAOYSA-N
XLogP2.06
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-ethenyl-1-methyl-4-propoxypiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1-methyl-4-propoxypiperidine?
The IUPAC name of 4-ethenyl-1-methyl-4-propoxypiperidine (CID 143860830) is 4-ethenyl-1-methyl-4-propoxypiperidine.
What is the SMILES notation for 4-ethenyl-1-methyl-4-propoxypiperidine?
The canonical SMILES for 4-ethenyl-1-methyl-4-propoxypiperidine is C=CC1(OCCC)CCN(C)CC1.
What is the InChIKey of 4-ethenyl-1-methyl-4-propoxypiperidine?
The InChIKey is KTSYUYSNGWRZQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-4-10-13-11(5-2)6-8-12(3)9-7-11/h5H,2,4,6-10H2,1,3H3.
What are the key properties of 4-ethenyl-1-methyl-4-propoxypiperidine?
4-ethenyl-1-methyl-4-propoxypiperidine has a molecular weight of 183.29 g/mol, XLogP of 2.06, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1-methyl-4-propoxypiperidine is sourced from PubChem (CID 143860830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).