1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one

C13H15NO2 — CID 107849710

IUPAC1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one
SMILESO=C1CC(O)CN1C1Cc2ccccc2C1
InChIInChI=1S/C13H15NO2/c15-12-7-13(16)14(8-12)11-5-9-3-1-2-4-10(9)6-11/h1-4,11-12,15H,5-8H2
InChIKeyXBPKEWNSQBBJEJ-UHFFFAOYSA-N
MW217.27 g/mol
LogP0.75
Rot. Bonds1

About 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one

1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one (PubChem CID 107849710) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one.

Molecular Properties

Compound Name1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one
PubChem CID107849710
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one
SMILESO=C1CC(O)CN1C1Cc2ccccc2C1
InChIInChI=1S/C13H15NO2/c15-12-7-13(16)14(8-12)11-5-9-3-1-2-4-10(9)6-11/h1-4,11-12,15H,5-8H2
InChIKeyXBPKEWNSQBBJEJ-UHFFFAOYSA-N
XLogP0.75
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one?
The IUPAC name of 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one (CID 107849710) is 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one.
What is the SMILES notation for 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one?
The canonical SMILES for 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one is O=C1CC(O)CN1C1Cc2ccccc2C1.
What is the InChIKey of 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one?
The InChIKey is XBPKEWNSQBBJEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c15-12-7-13(16)14(8-12)11-5-9-3-1-2-4-10(9)6-11/h1-4,11-12,15H,5-8H2.
What are the key properties of 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one?
1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one has a molecular weight of 217.27 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1H-inden-2-yl)-4-hydroxypyrrolidin-2-one is sourced from PubChem (CID 107849710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).