4-ethyl-4-(methoxymethyl)-3-propylpiperidine

C12H25NO — CID 79320812

IUPAC4-ethyl-4-(methoxymethyl)-3-propylpiperidine
SMILESCCCC1CNCCC1(CC)COC
InChIInChI=1S/C12H25NO/c1-4-6-11-9-13-8-7-12(11,5-2)10-14-3/h11,13H,4-10H2,1-3H3
InChIKeyHZMFSADLGOOVEW-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.44
Rot. Bonds5

About 4-ethyl-4-(methoxymethyl)-3-propylpiperidine

4-ethyl-4-(methoxymethyl)-3-propylpiperidine (PubChem CID 79320812) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 4-ethyl-4-(methoxymethyl)-3-propylpiperidine.

Molecular Properties

Compound Name4-ethyl-4-(methoxymethyl)-3-propylpiperidine
PubChem CID79320812
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name4-ethyl-4-(methoxymethyl)-3-propylpiperidine
SMILESCCCC1CNCCC1(CC)COC
InChIInChI=1S/C12H25NO/c1-4-6-11-9-13-8-7-12(11,5-2)10-14-3/h11,13H,4-10H2,1-3H3
InChIKeyHZMFSADLGOOVEW-UHFFFAOYSA-N
XLogP2.44
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-4-(methoxymethyl)-3-propylpiperidine 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-ethyl-4-(methoxymethyl)-3-propylpiperidine?
The IUPAC name of 4-ethyl-4-(methoxymethyl)-3-propylpiperidine (CID 79320812) is 4-ethyl-4-(methoxymethyl)-3-propylpiperidine.
What is the SMILES notation for 4-ethyl-4-(methoxymethyl)-3-propylpiperidine?
The canonical SMILES for 4-ethyl-4-(methoxymethyl)-3-propylpiperidine is CCCC1CNCCC1(CC)COC.
What is the InChIKey of 4-ethyl-4-(methoxymethyl)-3-propylpiperidine?
The InChIKey is HZMFSADLGOOVEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-4-6-11-9-13-8-7-12(11,5-2)10-14-3/h11,13H,4-10H2,1-3H3.
What are the key properties of 4-ethyl-4-(methoxymethyl)-3-propylpiperidine?
4-ethyl-4-(methoxymethyl)-3-propylpiperidine has a molecular weight of 199.34 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-4-(methoxymethyl)-3-propylpiperidine is sourced from PubChem (CID 79320812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).