2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol

C9H19NO2 — CID 129495167

IUPAC2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol
SMILESCCOC[C@H]1CCCN1CCO
InChIInChI=1S/C9H19NO2/c1-2-12-8-9-4-3-5-10(9)6-7-11/h9,11H,2-8H2,1H3/t9-/m1/s1
InChIKeyGFRVSWAXDKWQRV-SECBINFHSA-N
MW173.26 g/mol
LogP0.48
Rot. Bonds5

About 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol

2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol (PubChem CID 129495167) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol
PubChem CID129495167
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol
SMILESCCOC[C@H]1CCCN1CCO
InChIInChI=1S/C9H19NO2/c1-2-12-8-9-4-3-5-10(9)6-7-11/h9,11H,2-8H2,1H3/t9-/m1/s1
InChIKeyGFRVSWAXDKWQRV-SECBINFHSA-N
XLogP0.48
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol?
The IUPAC name of 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol (CID 129495167) is 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol.
What is the SMILES notation for 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol?
The canonical SMILES for 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol is CCOC[C@H]1CCCN1CCO.
What is the InChIKey of 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol?
The InChIKey is GFRVSWAXDKWQRV-SECBINFHSA-N. The full InChI is InChI=1S/C9H19NO2/c1-2-12-8-9-4-3-5-10(9)6-7-11/h9,11H,2-8H2,1H3/t9-/m1/s1.
What are the key properties of 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol?
2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol has a molecular weight of 173.26 g/mol, XLogP of 0.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-(ethoxymethyl)pyrrolidin-1-yl]ethanol is sourced from PubChem (CID 129495167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).