1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one

C14H18N2O2 — CID 118739171

IUPAC1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2CC12CCN(CCO)C2
InChIInChI=1S/C14H18N2O2/c17-8-7-16-6-5-14(10-16)9-11-3-1-2-4-12(11)15-13(14)18/h1-4,17H,5-10H2,(H,15,18)
InChIKeyDCXVFWJNKLNABZ-UHFFFAOYSA-N
MW246.31 g/mol
LogP0.87
Rot. Bonds2

About 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one

1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one (PubChem CID 118739171) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one
PubChem CID118739171
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2CC12CCN(CCO)C2
InChIInChI=1S/C14H18N2O2/c17-8-7-16-6-5-14(10-16)9-11-3-1-2-4-12(11)15-13(14)18/h1-4,17H,5-10H2,(H,15,18)
InChIKeyDCXVFWJNKLNABZ-UHFFFAOYSA-N
XLogP0.87
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one?
The IUPAC name of 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one (CID 118739171) is 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one?
The canonical SMILES for 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one is O=C1Nc2ccccc2CC12CCN(CCO)C2.
What is the InChIKey of 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one?
The InChIKey is DCXVFWJNKLNABZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c17-8-7-16-6-5-14(10-16)9-11-3-1-2-4-12(11)15-13(14)18/h1-4,17H,5-10H2,(H,15,18).
What are the key properties of 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one?
1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one has a molecular weight of 246.31 g/mol, XLogP of 0.87, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(2-hydroxyethyl)spiro[1,4-dihydroquinoline-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 118739171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).