5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol

C11H24N2O2 — CID 81056012

IUPAC5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol
SMILESCC(C)OCCN(C)CC1CC(O)CN1
InChIInChI=1S/C11H24N2O2/c1-9(2)15-5-4-13(3)8-10-6-11(14)7-12-10/h9-12,14H,4-8H2,1-3H3
InChIKeyZWAAOFREHPXHLS-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.07
Rot. Bonds6

About 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol

5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol (PubChem CID 81056012) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol.

Molecular Properties

Compound Name5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol
PubChem CID81056012
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol
SMILESCC(C)OCCN(C)CC1CC(O)CN1
InChIInChI=1S/C11H24N2O2/c1-9(2)15-5-4-13(3)8-10-6-11(14)7-12-10/h9-12,14H,4-8H2,1-3H3
InChIKeyZWAAOFREHPXHLS-UHFFFAOYSA-N
XLogP0.07
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 ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol?
The IUPAC name of 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol (CID 81056012) is 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol.
What is the SMILES notation for 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol?
The canonical SMILES for 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol is CC(C)OCCN(C)CC1CC(O)CN1.
What is the InChIKey of 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol?
The InChIKey is ZWAAOFREHPXHLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-9(2)15-5-4-13(3)8-10-6-11(14)7-12-10/h9-12,14H,4-8H2,1-3H3.
What are the key properties of 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol?
5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol has a molecular weight of 216.32 g/mol, XLogP of 0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[methyl(2-propan-2-yloxyethyl)amino]methyl]pyrrolidin-3-ol is sourced from PubChem (CID 81056012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).