2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol

C11H24N2O2 — CID 120899797

IUPAC2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol
SMILESCOCCN(CCO)CC1(C)CCNC1
InChIInChI=1S/C11H24N2O2/c1-11(3-4-12-9-11)10-13(5-7-14)6-8-15-2/h12,14H,3-10H2,1-2H3
InChIKeyCQXJSNCCKHAVTB-UHFFFAOYSA-N
MW216.32 g/mol
LogP-0.07
Rot. Bonds7

About 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol

2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol (PubChem CID 120899797) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol
PubChem CID120899797
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol
SMILESCOCCN(CCO)CC1(C)CCNC1
InChIInChI=1S/C11H24N2O2/c1-11(3-4-12-9-11)10-13(5-7-14)6-8-15-2/h12,14H,3-10H2,1-2H3
InChIKeyCQXJSNCCKHAVTB-UHFFFAOYSA-N
XLogP-0.07
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol?
The IUPAC name of 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol (CID 120899797) is 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol.
What is the SMILES notation for 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol?
The canonical SMILES for 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol is COCCN(CCO)CC1(C)CCNC1.
What is the InChIKey of 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol?
The InChIKey is CQXJSNCCKHAVTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-11(3-4-12-9-11)10-13(5-7-14)6-8-15-2/h12,14H,3-10H2,1-2H3.
What are the key properties of 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol?
2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol has a molecular weight of 216.32 g/mol, XLogP of -0.07, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl-[(3-methylpyrrolidin-3-yl)methyl]amino]ethanol is sourced from PubChem (CID 120899797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).