4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol

C11H24N2O2 — CID 63701591

IUPAC4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol
SMILESCOCCN(CC(C)C)C1CNCC1O
InChIInChI=1S/C11H24N2O2/c1-9(2)8-13(4-5-15-3)10-6-12-7-11(10)14/h9-12,14H,4-8H2,1-3H3
InChIKeyXOXKPFWREZJSOH-UHFFFAOYSA-N
MW216.32 g/mol
LogP-0.08
Rot. Bonds6

About 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol

4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol (PubChem CID 63701591) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol.

Molecular Properties

Compound Name4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol
PubChem CID63701591
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol
SMILESCOCCN(CC(C)C)C1CNCC1O
InChIInChI=1S/C11H24N2O2/c1-9(2)8-13(4-5-15-3)10-6-12-7-11(10)14/h9-12,14H,4-8H2,1-3H3
InChIKeyXOXKPFWREZJSOH-UHFFFAOYSA-N
XLogP-0.08
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 5-0.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol?
The IUPAC name of 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol (CID 63701591) is 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol.
What is the SMILES notation for 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol?
The canonical SMILES for 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol is COCCN(CC(C)C)C1CNCC1O.
What is the InChIKey of 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol?
The InChIKey is XOXKPFWREZJSOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-9(2)8-13(4-5-15-3)10-6-12-7-11(10)14/h9-12,14H,4-8H2,1-3H3.
What are the key properties of 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol?
4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol has a molecular weight of 216.32 g/mol, XLogP of -0.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-methoxyethyl(2-methylpropyl)amino]pyrrolidin-3-ol is sourced from PubChem (CID 63701591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).