2-hydroxy-1-pyrrolidin-1-ylethanone

C6H11NO2 — CID 6480485

IUPAC2-hydroxy-1-pyrrolidin-1-ylethanone
SMILESO=C(CO)N1CCCC1
InChIInChI=1S/C6H11NO2/c8-5-6(9)7-3-1-2-4-7/h8H,1-5H2
InChIKeyRWGVUODVPQFWCJ-UHFFFAOYSA-N
MW129.16 g/mol
LogP-0.40
Rot. Bonds1

About 2-hydroxy-1-pyrrolidin-1-ylethanone

2-hydroxy-1-pyrrolidin-1-ylethanone (PubChem CID 6480485) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 2-hydroxy-1-pyrrolidin-1-ylethanone.

Molecular Properties

Compound Name2-hydroxy-1-pyrrolidin-1-ylethanone
PubChem CID6480485
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name2-hydroxy-1-pyrrolidin-1-ylethanone
SMILESO=C(CO)N1CCCC1
InChIInChI=1S/C6H11NO2/c8-5-6(9)7-3-1-2-4-7/h8H,1-5H2
InChIKeyRWGVUODVPQFWCJ-UHFFFAOYSA-N
XLogP-0.40
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 5-0.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-1-pyrrolidin-1-ylethanone?
The IUPAC name of 2-hydroxy-1-pyrrolidin-1-ylethanone (CID 6480485) is 2-hydroxy-1-pyrrolidin-1-ylethanone.
What is the SMILES notation for 2-hydroxy-1-pyrrolidin-1-ylethanone?
The canonical SMILES for 2-hydroxy-1-pyrrolidin-1-ylethanone is O=C(CO)N1CCCC1.
What is the InChIKey of 2-hydroxy-1-pyrrolidin-1-ylethanone?
The InChIKey is RWGVUODVPQFWCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c8-5-6(9)7-3-1-2-4-7/h8H,1-5H2.
What are the key properties of 2-hydroxy-1-pyrrolidin-1-ylethanone?
2-hydroxy-1-pyrrolidin-1-ylethanone has a molecular weight of 129.16 g/mol, XLogP of -0.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-1-pyrrolidin-1-ylethanone is sourced from PubChem (CID 6480485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).