1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine

C13H26N2O — CID 102963677

IUPAC1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine
SMILESCCC1(CN2CCCC(OC)C2)CCNC1
InChIInChI=1S/C13H26N2O/c1-3-13(6-7-14-10-13)11-15-8-4-5-12(9-15)16-2/h12,14H,3-11H2,1-2H3
InChIKeyWIUDRCBTZBVTFW-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds4

About 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine

1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine (PubChem CID 102963677) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine.

Molecular Properties

Compound Name1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine
PubChem CID102963677
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine
SMILESCCC1(CN2CCCC(OC)C2)CCNC1
InChIInChI=1S/C13H26N2O/c1-3-13(6-7-14-10-13)11-15-8-4-5-12(9-15)16-2/h12,14H,3-11H2,1-2H3
InChIKeyWIUDRCBTZBVTFW-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
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-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine 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

3-methoxy-1-[(4-propylpiperidin-4-yl)methyl]piperidine
CID 102963889
3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine
CID 55167023
1-[(4-ethylpiperidin-4-yl)methyl]-3-propoxypiperidine
CID 63129663
1-[(3-ethylpyrrolidin-3-yl)methyl]-3-pyrrolidin-1-ylpyrrolidine
CID 55224749
1-[(4-ethylpiperidin-4-yl)methyl]-4-methoxypiperidine
CID 55177605
N-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclopentyl]methyl]propan-2-amine
CID 102967390
2-[1-[(3-methoxypiperidin-1-yl)methyl]cyclopropyl]acetic acid
CID 102968613
1-[(3-ethylpyrrolidin-3-yl)methyl]-4-(methoxymethyl)piperidine
CID 63979218
4-[[1-[(3-methoxypiperidin-1-yl)methyl]cyclohexyl]methyl]morpholine
CID 84592709
N-[[1-[(3-methoxypiperidin-1-yl)methyl]cycloheptyl]methyl]propan-1-amine
CID 102967363
1-(cyclopropylmethyl)-4-[(3-ethylpyrrolidin-3-yl)methyl]piperazine
CID 55165550
1-[(3-ethylpyrrolidin-3-yl)methyl]-3,6-dihydro-2H-pyridine
CID 114410666

Frequently Asked Questions

What is the IUPAC name of 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine?
The IUPAC name of 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine (CID 102963677) is 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine.
What is the SMILES notation for 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine?
The canonical SMILES for 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine is CCC1(CN2CCCC(OC)C2)CCNC1.
What is the InChIKey of 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine?
The InChIKey is WIUDRCBTZBVTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-13(6-7-14-10-13)11-15-8-4-5-12(9-15)16-2/h12,14H,3-11H2,1-2H3.
What are the key properties of 1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine?
1-[(3-ethylpyrrolidin-3-yl)methyl]-3-methoxypiperidine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 4 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]-3-methoxypiperidine is sourced from PubChem (CID 102963677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).