(3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine

C9H19NO2 — CID 86324088

IUPAC(3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine
SMILESCOCCOCC[C@H]1CCNC1
InChIInChI=1S/C9H19NO2/c1-11-6-7-12-5-3-9-2-4-10-8-9/h9-10H,2-8H2,1H3/t9-/m1/s1
InChIKeyGXWQLMDRJDEBGG-SECBINFHSA-N
MW173.26 g/mol
LogP0.65
Rot. Bonds6

About (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine

(3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine (PubChem CID 86324088) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine.

Molecular Properties

Compound Name(3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine
PubChem CID86324088
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name(3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine
SMILESCOCCOCC[C@H]1CCNC1
InChIInChI=1S/C9H19NO2/c1-11-6-7-12-5-3-9-2-4-10-8-9/h9-10H,2-8H2,1H3/t9-/m1/s1
InChIKeyGXWQLMDRJDEBGG-SECBINFHSA-N
XLogP0.65
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(2-propoxyethyl)pyrrolidine
CID 114796170
3-[3-(2-methoxyethoxy)propyl]piperidine
CID 103413398
methyl 4-(2-pyrrolidin-3-ylethoxy)butanoate
CID 106940991
3-(2-heptoxyethyl)pyrrolidine
CID 114795978
3-(2-pyrrolidin-3-ylethoxy)propanamide
CID 114795988
3-[2-(2-ethylsulfanylethoxy)ethyl]pyrrolidine
CID 114796226
(3S)-3-(2-methoxyethyl)azepane
CID 97297954
3-[2-(methoxymethoxy)ethyl]piperidine
CID 106938134
3-(4-methoxybutoxymethyl)pyrrolidine
CID 104648277
3-[2-(2-ethoxyethoxy)ethyl]piperidine;hydrochloride
CID 56829882
1-(2-pyrrolidin-3-ylethoxy)propan-2-ol
CID 106939109
3-[2-(2-butoxyethoxy)ethyl]piperidine
CID 62357528

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine?
The IUPAC name of (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine (CID 86324088) is (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine.
What is the SMILES notation for (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine?
The canonical SMILES for (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine is COCCOCC[C@H]1CCNC1.
What is the InChIKey of (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine?
The InChIKey is GXWQLMDRJDEBGG-SECBINFHSA-N. The full InChI is InChI=1S/C9H19NO2/c1-11-6-7-12-5-3-9-2-4-10-8-9/h9-10H,2-8H2,1H3/t9-/m1/s1.
What are the key properties of (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine?
(3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine has a molecular weight of 173.26 g/mol, XLogP of 0.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[2-(2-methoxyethoxy)ethyl]pyrrolidine is sourced from PubChem (CID 86324088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).