3-ethyl-1-(3-methoxypropyl)piperidine

C11H23NO — CID 142531996

IUPAC3-ethyl-1-(3-methoxypropyl)piperidine
SMILESCCC1CCCN(CCCOC)C1
InChIInChI=1S/C11H23NO/c1-3-11-6-4-7-12(10-11)8-5-9-13-2/h11H,3-10H2,1-2H3
InChIKeyGCQZHAMKANYFTP-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.14
Rot. Bonds5

About 3-ethyl-1-(3-methoxypropyl)piperidine

3-ethyl-1-(3-methoxypropyl)piperidine (PubChem CID 142531996) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 3-ethyl-1-(3-methoxypropyl)piperidine.

Molecular Properties

Compound Name3-ethyl-1-(3-methoxypropyl)piperidine
PubChem CID142531996
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name3-ethyl-1-(3-methoxypropyl)piperidine
SMILESCCC1CCCN(CCCOC)C1
InChIInChI=1S/C11H23NO/c1-3-11-6-4-7-12(10-11)8-5-9-13-2/h11H,3-10H2,1-2H3
InChIKeyGCQZHAMKANYFTP-UHFFFAOYSA-N
XLogP2.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-ethyl-1-(3-methoxypropyl)piperidine 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 3-ethyl-1-(3-methoxypropyl)piperidine?
The IUPAC name of 3-ethyl-1-(3-methoxypropyl)piperidine (CID 142531996) is 3-ethyl-1-(3-methoxypropyl)piperidine.
What is the SMILES notation for 3-ethyl-1-(3-methoxypropyl)piperidine?
The canonical SMILES for 3-ethyl-1-(3-methoxypropyl)piperidine is CCC1CCCN(CCCOC)C1.
What is the InChIKey of 3-ethyl-1-(3-methoxypropyl)piperidine?
The InChIKey is GCQZHAMKANYFTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-11-6-4-7-12(10-11)8-5-9-13-2/h11H,3-10H2,1-2H3.
What are the key properties of 3-ethyl-1-(3-methoxypropyl)piperidine?
3-ethyl-1-(3-methoxypropyl)piperidine has a molecular weight of 185.31 g/mol, XLogP of 2.14, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(3-methoxypropyl)piperidine is sourced from PubChem (CID 142531996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).