1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine

C11H23NO2 — CID 77147850

IUPAC1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine
SMILESCOCCOCCN1CCCC(C)C1
InChIInChI=1S/C11H23NO2/c1-11-4-3-5-12(10-11)6-7-14-9-8-13-2/h11H,3-10H2,1-2H3
InChIKeyGEROTQQOQKLYLQ-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.38
Rot. Bonds6

About 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine

1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine (PubChem CID 77147850) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine.

Molecular Properties

Compound Name1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine
PubChem CID77147850
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine
SMILESCOCCOCCN1CCCC(C)C1
InChIInChI=1S/C11H23NO2/c1-11-4-3-5-12(10-11)6-7-14-9-8-13-2/h11H,3-10H2,1-2H3
InChIKeyGEROTQQOQKLYLQ-UHFFFAOYSA-N
XLogP1.38
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-chloro-1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]piperidine
CID 104567095
3-(chloromethyl)-1-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]piperidine
CID 104567099
2-[2-(2-methoxyethoxy)ethyl]-1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepine
CID 79885800
N-(2-methoxyethyl)-2-(3-methylpiperidin-1-yl)ethanamine
CID 62575106
methyl 1-[2-(2-methoxyethoxy)ethyl]piperidine-3-carboxylate
CID 79884507
1-[2-[2-(2-methoxyphenoxy)ethoxy]ethyl]-3-methylpiperidine
CID 2934115
1-[4-(2-methoxyethoxy)butyl]-3-methyl-1,4-diazepane
CID 113464190
3-[1-[2-(2-methoxyethoxy)ethyl]piperidin-3-yl]butanoic acid
CID 81046673
1-[2-(2-methoxyethoxy)ethyl]-N,N-dimethylpiperidine-3-carboxamide
CID 75424732
3-cyclopropyl-1-[2-(2-methoxyethoxy)ethyl]-1,4-diazepane
CID 64872115
3-chloro-1-(2-methoxyethyl)piperidine
CID 63386779
(3S)-1-[2-[2-(2-fluorophenoxy)ethoxy]ethyl]-3-methylpiperidine
CID 2182375

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine?
The IUPAC name of 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine (CID 77147850) is 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine.
What is the SMILES notation for 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine?
The canonical SMILES for 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine is COCCOCCN1CCCC(C)C1.
What is the InChIKey of 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine?
The InChIKey is GEROTQQOQKLYLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-11-4-3-5-12(10-11)6-7-14-9-8-13-2/h11H,3-10H2,1-2H3.
What are the key properties of 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine?
1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine has a molecular weight of 201.31 g/mol, XLogP of 1.38, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyethoxy)ethyl]-3-methylpiperidine is sourced from PubChem (CID 77147850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).