(3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol

C7H15NO2 — CID 143593756

IUPAC(3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol
SMILESCOCC[C@@H]1C[C@H](O)CN1
InChIInChI=1S/C7H15NO2/c1-10-3-2-6-4-7(9)5-8-6/h6-9H,2-5H2,1H3/t6-,7+/m1/s1
InChIKeyTZAQDUQRICZFJE-RQJHMYQMSA-N
MW145.20 g/mol
LogP-0.25
Rot. Bonds3

About (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol

(3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol (PubChem CID 143593756) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name(3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol
PubChem CID143593756
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name(3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol
SMILESCOCC[C@@H]1C[C@H](O)CN1
InChIInChI=1S/C7H15NO2/c1-10-3-2-6-4-7(9)5-8-6/h6-9H,2-5H2,1H3/t6-,7+/m1/s1
InChIKeyTZAQDUQRICZFJE-RQJHMYQMSA-N
XLogP-0.25
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.20
LogP ≤ 5-0.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R,3S,4R)-2-[(1S)-1,2-dihydroxyethyl]pyrrolidine-3,4-diol
CID 456279
1-(Pyrrolidin-2-yl)propan-2-ol
CID 12313545
(2S,3S,4R,5S)-2-(2-hydroxyethyl)-5-methylpyrrolidine-3,4-diol
CID 10103440
(2S,3S,4S)-2-[(1S)-1,2-dihydroxyethyl]pyrrolidine-3,4-diol
CID 10374754
(2R,3R,4R)-2-ethylpyrrolidine-3,4-diol
CID 55287220
1,4-Dideoxy-1,4-imino-D-tallitol
CID 451998
(2R,3R,4S)-2-ethylpyrrolidine-3,4-diol
CID 11804793
5-Methylpyrrolidin-3-ol
CID 21973779
(2R,3S,4S)-2-[(1S)-1,2-dihydroxyethyl]pyrrolidine-3,4-diol
CID 10877449
1-(Pyrrolidin-2-yl)ethan-1-ol
CID 10129930
1-[(2R)-pyrrolidin-2-yl]ethan-1-ol
CID 55299031
1-[(2S)-pyrrolidin-2-yl]ethan-1-ol
CID 68899378

Frequently Asked Questions

What is the IUPAC name of (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol?
The IUPAC name of (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol (CID 143593756) is (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol.
What is the SMILES notation for (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol?
The canonical SMILES for (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol is COCC[C@@H]1C[C@H](O)CN1.
What is the InChIKey of (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol?
The InChIKey is TZAQDUQRICZFJE-RQJHMYQMSA-N. The full InChI is InChI=1S/C7H15NO2/c1-10-3-2-6-4-7(9)5-8-6/h6-9H,2-5H2,1H3/t6-,7+/m1/s1.
What are the key properties of (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol?
(3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol has a molecular weight of 145.20 g/mol, XLogP of -0.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S,5R)-5-(2-methoxyethyl)pyrrolidin-3-ol is sourced from PubChem (CID 143593756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).