2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one

C11H19NO2 — CID 79543870

IUPAC2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one
SMILESO=C1CCCC1C1CCCN1CCO
InChIInChI=1S/C11H19NO2/c13-8-7-12-6-2-4-10(12)9-3-1-5-11(9)14/h9-10,13H,1-8H2
InChIKeyBCIJJVXEVOOVQD-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.81
Rot. Bonds3

About 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one

2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one (PubChem CID 79543870) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one.

Molecular Properties

Compound Name2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one
PubChem CID79543870
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Name2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one
SMILESO=C1CCCC1C1CCCN1CCO
InChIInChI=1S/C11H19NO2/c13-8-7-12-6-2-4-10(12)9-3-1-5-11(9)14/h9-10,13H,1-8H2
InChIKeyBCIJJVXEVOOVQD-UHFFFAOYSA-N
XLogP0.81
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one?
The IUPAC name of 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one (CID 79543870) is 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one.
What is the SMILES notation for 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one?
The canonical SMILES for 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one is O=C1CCCC1C1CCCN1CCO.
What is the InChIKey of 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one?
The InChIKey is BCIJJVXEVOOVQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c13-8-7-12-6-2-4-10(12)9-3-1-5-11(9)14/h9-10,13H,1-8H2.
What are the key properties of 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one?
2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one has a molecular weight of 197.28 g/mol, XLogP of 0.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-hydroxyethyl)pyrrolidin-2-yl]cyclopentan-1-one is sourced from PubChem (CID 79543870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).