(3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one

C15H19NO — CID 167207593

IUPAC(3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one
SMILESCC(C)c1ccc2c(c1)CC[C@@]21CCC(=O)N1
InChIInChI=1S/C15H19NO/c1-10(2)11-3-4-13-12(9-11)5-7-15(13)8-6-14(17)16-15/h3-4,9-10H,5-8H2,1-2H3,(H,16,17)/t15-/m1/s1
InChIKeyRTHSYPOZIRKJFD-OAHLLOKOSA-N
MW229.32 g/mol
LogP2.86
Rot. Bonds1

About (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one

(3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one (PubChem CID 167207593) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one.

Molecular Properties

Compound Name(3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one
PubChem CID167207593
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name(3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one
SMILESCC(C)c1ccc2c(c1)CC[C@@]21CCC(=O)N1
InChIInChI=1S/C15H19NO/c1-10(2)11-3-4-13-12(9-11)5-7-15(13)8-6-14(17)16-15/h3-4,9-10H,5-8H2,1-2H3,(H,16,17)/t15-/m1/s1
InChIKeyRTHSYPOZIRKJFD-OAHLLOKOSA-N
XLogP2.86
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one?
The IUPAC name of (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one (CID 167207593) is (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one.
What is the SMILES notation for (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one?
The canonical SMILES for (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one is CC(C)c1ccc2c(c1)CC[C@@]21CCC(=O)N1.
What is the InChIKey of (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one?
The InChIKey is RTHSYPOZIRKJFD-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H19NO/c1-10(2)11-3-4-13-12(9-11)5-7-15(13)8-6-14(17)16-15/h3-4,9-10H,5-8H2,1-2H3,(H,16,17)/t15-/m1/s1.
What are the key properties of (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one?
(3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one has a molecular weight of 229.32 g/mol, XLogP of 2.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-6-propan-2-ylspiro[1,2-dihydroindene-3,5'-pyrrolidine]-2'-one is sourced from PubChem (CID 167207593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).