[2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol

C11H21NO3 — CID 117168924

IUPAC[2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol
SMILESCCN1CCCC1C1(C)OCC(CO)O1
InChIInChI=1S/C11H21NO3/c1-3-12-6-4-5-10(12)11(2)14-8-9(7-13)15-11/h9-10,13H,3-8H2,1-2H3
InChIKeyMDCKISAGWHAXNB-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.59
Rot. Bonds3

About [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol

[2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol (PubChem CID 117168924) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol.

Molecular Properties

Compound Name[2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol
PubChem CID117168924
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Name[2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol
SMILESCCN1CCCC1C1(C)OCC(CO)O1
InChIInChI=1S/C11H21NO3/c1-3-12-6-4-5-10(12)11(2)14-8-9(7-13)15-11/h9-10,13H,3-8H2,1-2H3
InChIKeyMDCKISAGWHAXNB-UHFFFAOYSA-N
XLogP0.59
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol?
The IUPAC name of [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol (CID 117168924) is [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol.
What is the SMILES notation for [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol?
The canonical SMILES for [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol is CCN1CCCC1C1(C)OCC(CO)O1.
What is the InChIKey of [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol?
The InChIKey is MDCKISAGWHAXNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-3-12-6-4-5-10(12)11(2)14-8-9(7-13)15-11/h9-10,13H,3-8H2,1-2H3.
What are the key properties of [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol?
[2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol has a molecular weight of 215.29 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-ethylpyrrolidin-2-yl)-2-methyl-1,3-dioxolan-4-yl]methanol is sourced from PubChem (CID 117168924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).