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

C11H23NO3 — CID 103402661

IUPAC(2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine
SMILESCOCCOCCCOC[C@H]1CCCN1
InChIInChI=1S/C11H23NO3/c1-13-8-9-14-6-3-7-15-10-11-4-2-5-12-11/h11-12H,2-10H2,1H3/t11-/m1/s1
InChIKeyHVGBWDWUTQZKJH-LLVKDONJSA-N
MW217.31 g/mol
LogP0.81
Rot. Bonds9

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

(2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine (PubChem CID 103402661) has the molecular formula C11H23NO3 and a molecular weight of 217.31 g/mol. Its IUPAC name is (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine.

Molecular Properties

Compound Name(2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine
PubChem CID103402661
Molecular FormulaC11H23NO3
Molecular Weight217.31 g/mol
Exact Mass217.17
IUPAC Name(2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine
SMILESCOCCOCCCOC[C@H]1CCCN1
InChIInChI=1S/C11H23NO3/c1-13-8-9-14-6-3-7-15-10-11-4-2-5-12-11/h11-12H,2-10H2,1H3/t11-/m1/s1
InChIKeyHVGBWDWUTQZKJH-LLVKDONJSA-N
XLogP0.81
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(4-methoxybutoxymethyl)pyrrolidine
CID 104648269
2-(2-propoxyethoxymethyl)piperidine
CID 63684377
3-(2-methoxyethoxy)-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 106636763
(2R)-2-(octoxymethyl)pyrrolidine
CID 102820024
(2R)-2-[2-(2-methylpropoxy)ethoxymethyl]pyrrolidine
CID 106447713
2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine
CID 145216939
2-(3,3-dimethylbutoxymethyl)pyrrolidine
CID 62335099
(2S)-2-(methylperoxymethyl)pyrrolidine
CID 88881099
2-(4,4,4-trifluorobutoxymethyl)pyrrolidine
CID 115514545
(2R)-2-(4,4,4-trifluorobutoxymethyl)pyrrolidine
CID 102820223
2-[3-(2-methoxyethoxy)propyl-(pyrrolidin-2-ylmethyl)amino]ethanol
CID 106618388
N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-N-(pyrrolidin-2-ylmethyl)butan-1-amine
CID 106616773

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine?
The IUPAC name of (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine (CID 103402661) is (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine.
What is the SMILES notation for (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine?
The canonical SMILES for (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine is COCCOCCCOC[C@H]1CCCN1.
What is the InChIKey of (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine?
The InChIKey is HVGBWDWUTQZKJH-LLVKDONJSA-N. The full InChI is InChI=1S/C11H23NO3/c1-13-8-9-14-6-3-7-15-10-11-4-2-5-12-11/h11-12H,2-10H2,1H3/t11-/m1/s1.
What are the key properties of (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine?
(2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine has a molecular weight of 217.31 g/mol, XLogP of 0.81, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[3-(2-methoxyethoxy)propoxymethyl]pyrrolidine is sourced from PubChem (CID 103402661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).