Chemical Properties of 2-[2-Hydroxy-3-(N-methyl-2-pyrrolidinyl)propanyl]-N-methylpyrrolidine (isomer 1)

InChI

InChI=1S/C13H26N2O/c1-14-7-3-5-11(14)9-13(16)10-12-6-4-8-15(12)2/h11-13,16H,3-10H2,1-2H3

InChI Key

UOJNOOLFFFFKNA-UHFFFAOYSA-N

Formula

C13H26N2O

SMILES

CN1CCCC1CC(O)CC1CCCN1C

Molecular Weight¹

226.36

• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
log10WS	-1.79		Crippen Calculated Property
logPoct/wat	1.316		Crippen Calculated Property
McVol	198.140	ml/mol	McGowan Calculated Property
Inp	[1682.00; 1682.00]
Inp	1682.00		NIST
Inp	1682.00		NIST

Similar Compounds

Find more compounds similar to 2-[2-Hydroxy-3-(N-methyl-2-pyrrolidinyl)propanyl]-N-methylpyrrolidine (isomer 1).

Sources

• Crippen Method
• Crippen Method
• McGowan Method
• NIST Webbook

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