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

C18H19N3O — CID 118740605

IUPAC1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2CC12CCCN2Cc1cccnc1
InChIInChI=1S/C18H19N3O/c22-17-18(11-15-6-1-2-7-16(15)20-17)8-4-10-21(18)13-14-5-3-9-19-12-14/h1-3,5-7,9,12H,4,8,10-11,13H2,(H,20,22)
InChIKeyFEJNKSJSWPHFMT-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.61
Rot. Bonds2

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

1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one (PubChem CID 118740605) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one
PubChem CID118740605
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2CC12CCCN2Cc1cccnc1
InChIInChI=1S/C18H19N3O/c22-17-18(11-15-6-1-2-7-16(15)20-17)8-4-10-21(18)13-14-5-3-9-19-12-14/h1-3,5-7,9,12H,4,8,10-11,13H2,(H,20,22)
InChIKeyFEJNKSJSWPHFMT-UHFFFAOYSA-N
XLogP2.61
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1'-[[4-(trifluoromethyl)phenyl]methyl]spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one
CID 118740606
1'-[[4-(trifluoromethyl)phenyl]methyl]spiro[1,4-dihydroquinoline-3,2'-azetidine]-2-one
CID 134794506
1'-[[4-(trifluoromethoxy)phenyl]methyl]spiro[1,4-dihydroquinoline-3,2'-azetidine]-2-one
CID 134792732
1'-[[2-(trifluoromethyl)phenyl]methyl]spiro[1,4-dihydroquinoline-3,2'-azetidine]-2-one
CID 134791744
1'-[(5-bromo-2-pyridinyl)methyl]spiro[2,5-dihydro-1H-2-benzazepine-4,2'-pyrrolidine]-3-one
CID 134789199
1'-[(3-ethoxyphenyl)methyl]spiro[2,5-dihydro-1H-2-benzazepine-4,2'-piperidine]-3-one
CID 134787435
1'-(2-hydroxy-2-pyridin-3-ylethyl)spiro[1,4-dihydroquinoline-3,4'-piperidine]-2-one
CID 166265649
1'-(3-methylbutyl)spiro[1,4-dihydroquinoline-3,2'-azetidine]-2-one
CID 134793461
1-(pyridin-3-ylmethyl)-3,4-dihydroquinoxalin-2-one
CID 62876131
2,2-dimethyl-1-(pyridin-3-ylmethyl)-1,5-diazocane
CID 117014799
1'-[[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]methyl]spiro[2,5-dihydro-1H-2-benzazepine-4,2'-pyrrolidine]-3-one
CID 134790376
1'-[(2-methoxyphenyl)methyl]spiro[2,5-dihydro-1H-2-benzazepine-4,2'-pyrrolidine]-3-one
CID 134790713

Frequently Asked Questions

What is the IUPAC name of 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one?
The IUPAC name of 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one (CID 118740605) is 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one.
What is the SMILES notation for 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one?
The canonical SMILES for 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one is O=C1Nc2ccccc2CC12CCCN2Cc1cccnc1.
What is the InChIKey of 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one?
The InChIKey is FEJNKSJSWPHFMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c22-17-18(11-15-6-1-2-7-16(15)20-17)8-4-10-21(18)13-14-5-3-9-19-12-14/h1-3,5-7,9,12H,4,8,10-11,13H2,(H,20,22).
What are the key properties of 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one?
1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one has a molecular weight of 293.37 g/mol, XLogP of 2.61, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(pyridin-3-ylmethyl)spiro[1,4-dihydroquinoline-3,2'-pyrrolidine]-2-one is sourced from PubChem (CID 118740605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).