(3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone

C11H19NO3 — CID 103773754

IUPAC(3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone
SMILESCC1CCC(C(=O)N2CCC(C)(O)C2)O1
InChIInChI=1S/C11H19NO3/c1-8-3-4-9(15-8)10(13)12-6-5-11(2,14)7-12/h8-9,14H,3-7H2,1-2H3
InChIKeyDBKJOSDATTUSJD-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.54
Rot. Bonds1

About (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone

(3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone (PubChem CID 103773754) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone.

Molecular Properties

Compound Name(3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone
PubChem CID103773754
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name(3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone
SMILESCC1CCC(C(=O)N2CCC(C)(O)C2)O1
InChIInChI=1S/C11H19NO3/c1-8-3-4-9(15-8)10(13)12-6-5-11(2,14)7-12/h8-9,14H,3-7H2,1-2H3
InChIKeyDBKJOSDATTUSJD-UHFFFAOYSA-N
XLogP0.54
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone?
The IUPAC name of (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone (CID 103773754) is (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone.
What is the SMILES notation for (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone?
The canonical SMILES for (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone is CC1CCC(C(=O)N2CCC(C)(O)C2)O1.
What is the InChIKey of (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone?
The InChIKey is DBKJOSDATTUSJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-8-3-4-9(15-8)10(13)12-6-5-11(2,14)7-12/h8-9,14H,3-7H2,1-2H3.
What are the key properties of (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone?
(3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone has a molecular weight of 213.28 g/mol, XLogP of 0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-hydroxy-3-methylpyrrolidin-1-yl)-(5-methyloxolan-2-yl)methanone is sourced from PubChem (CID 103773754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).