1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine

C14H28N2O — CID 63979218

IUPAC1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine
SMILESCCC1(CN2CCC(COC)CC2)CCNC1
InChIInChI=1S/C14H28N2O/c1-3-14(6-7-15-11-14)12-16-8-4-13(5-9-16)10-17-2/h13,15H,3-12H2,1-2H3
InChIKeyWIXLJWUAYWEXSC-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.73
Rot. Bonds5

About 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine

1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine (PubChem CID 63979218) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine.

Molecular Properties

Compound Name1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine
PubChem CID63979218
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine
SMILESCCC1(CN2CCC(COC)CC2)CCNC1
InChIInChI=1S/C14H28N2O/c1-3-14(6-7-15-11-14)12-16-8-4-13(5-9-16)10-17-2/h13,15H,3-12H2,1-2H3
InChIKeyWIXLJWUAYWEXSC-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine 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

4-(Methoxymethyl)-4-methylpiperidine
CID 22507725
4-(Methoxymethyl)-2-methyl-2,8-diazaspiro[4.5]decane
CID 90488143
N-methyl-1-(oxolan-3-ylmethyl)piperidin-4-amine
CID 54594205
7-(2-Methoxyethyl)-2,7-diazaspiro[4.5]decane
CID 56882262
N-[[3-[[4-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-yl]methyl]ethanamine
CID 65531651
N-[[3-[[4-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-yl]methyl]propan-1-amine
CID 65532232
N-methyl-1-[3-[[4-(trifluoromethyl)piperidin-1-yl]methyl]oxolan-3-yl]methanamine
CID 65532620
1-[4-(methoxymethyl)piperidin-4-yl]-N,N-dimethylmethanamine
CID 108122414
1-Methanidyl-4-(methoxymethyl)piperidin-1-ium
CID 59130943
4-(2-Pyrrolidin-1-ylethoxymethyl)piperidine
CID 62338872
4-Ethyl-4-(methoxymethyl)piperidine
CID 64395776
2-(2-Methoxyethyl)-2,8-diazaspiro[4.5]decane
CID 82469323

Frequently Asked Questions

What is the IUPAC name of 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine?
The IUPAC name of 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine (CID 63979218) is 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine.
What is the SMILES notation for 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine?
The canonical SMILES for 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine is CCC1(CN2CCC(COC)CC2)CCNC1.
What is the InChIKey of 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine?
The InChIKey is WIXLJWUAYWEXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-14(6-7-15-11-14)12-16-8-4-13(5-9-16)10-17-2/h13,15H,3-12H2,1-2H3.
What are the key properties of 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine?
1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine has a molecular weight of 240.39 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine is sourced from PubChem (CID 63979218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).