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

C7H15NO2 — CID 164662041

IUPAC2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol
SMILESCOCC(O)[C@H]1CCCN1
InChIInChI=1S/C7H15NO2/c1-10-5-7(9)6-3-2-4-8-6/h6-9H,2-5H2,1H3/t6-,7?/m1/s1
InChIKeyMARAOLKDGAPAFX-ULUSZKPHSA-N
MW145.20 g/mol
LogP-0.25
Rot. Bonds3

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

2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol (PubChem CID 164662041) has the molecular formula C7H15NO2 and a molecular weight of 145.20 g/mol. Its IUPAC name is 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol.

Molecular Properties

Compound Name2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol
PubChem CID164662041
Molecular FormulaC7H15NO2
Molecular Weight145.20 g/mol
Exact Mass145.11
IUPAC Name2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol
SMILESCOCC(O)[C@H]1CCCN1
InChIInChI=1S/C7H15NO2/c1-10-5-7(9)6-3-2-4-8-6/h6-9H,2-5H2,1H3/t6-,7?/m1/s1
InChIKeyMARAOLKDGAPAFX-ULUSZKPHSA-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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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol?
The IUPAC name of 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol (CID 164662041) is 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol.
What is the SMILES notation for 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol?
The canonical SMILES for 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol is COCC(O)[C@H]1CCCN1.
What is the InChIKey of 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol?
The InChIKey is MARAOLKDGAPAFX-ULUSZKPHSA-N. The full InChI is InChI=1S/C7H15NO2/c1-10-5-7(9)6-3-2-4-8-6/h6-9H,2-5H2,1H3/t6-,7?/m1/s1.
What are the key properties of 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol?
2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol 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 2-methoxy-1-[(2R)-pyrrolidin-2-yl]ethanol is sourced from PubChem (CID 164662041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).