1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine

C13H26N2O — CID 107396240

IUPAC1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine
SMILESCCC1CNCC1N1CCCC(C)(OC)C1
InChIInChI=1S/C13H26N2O/c1-4-11-8-14-9-12(11)15-7-5-6-13(2,10-15)16-3/h11-12,14H,4-10H2,1-3H3
InChIKeyNJYJKZZIRHKLIV-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds3

About 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine

1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine (PubChem CID 107396240) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine.

Molecular Properties

Compound Name1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine
PubChem CID107396240
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine
SMILESCCC1CNCC1N1CCCC(C)(OC)C1
InChIInChI=1S/C13H26N2O/c1-4-11-8-14-9-12(11)15-7-5-6-13(2,10-15)16-3/h11-12,14H,4-10H2,1-3H3
InChIKeyNJYJKZZIRHKLIV-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine with MolForge

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

Launch Full Analysis

Related Compounds

N-ethyl-2-(3-methoxy-3-methylpiperidin-1-yl)cyclooctan-1-amine
CID 107392190
5-(3-methoxy-3-methylpiperidin-1-yl)-2,2-dimethylcyclopentan-1-amine
CID 107391771
5-(3-methoxy-3-methylpiperidin-1-yl)-2,2-dimethylcyclopentan-1-ol
CID 107394568
4-(3-methoxy-3-methylpiperidin-1-yl)-1,1-dioxothiolan-3-ol
CID 107394230
4-(3-methoxy-3-methylpiperidin-1-yl)-N-propylcyclohexan-1-amine
CID 107396577
azetidin-3-yl-(3-methoxy-3-methylpiperidin-1-yl)methanone
CID 107392334
1-[4-(4-ethylpyrrolidin-3-yl)-1,4-diazepan-1-yl]ethanone
CID 79025947
7-(3-methoxy-3-methylpiperidin-1-yl)-1,4-dioxaspiro[4.5]decan-8-ol
CID 107394567
2-[1-(4-ethylpyrrolidin-3-yl)piperidin-3-yl]ethanol
CID 107229150
3-methoxy-3-methyl-1-[(4-propylpiperidin-4-yl)methyl]piperidine
CID 107393283
1-(4-ethylpyrrolidin-3-yl)-2,3,3a,4,5,6,7,7a-octahydroindole
CID 82751701
1-(3-methoxy-3-methylpiperidin-1-yl)-2-pyrrolidin-3-ylethanone
CID 107392439

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine?
The IUPAC name of 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine (CID 107396240) is 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine.
What is the SMILES notation for 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine?
The canonical SMILES for 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine is CCC1CNCC1N1CCCC(C)(OC)C1.
What is the InChIKey of 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine?
The InChIKey is NJYJKZZIRHKLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-11-8-14-9-12(11)15-7-5-6-13(2,10-15)16-3/h11-12,14H,4-10H2,1-3H3.
What are the key properties of 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine?
1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylpyrrolidin-3-yl)-3-methoxy-3-methylpiperidine is sourced from PubChem (CID 107396240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).