1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one

C19H19N3O3 — CID 162633325

IUPAC1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
SMILESCCc1[nH]c(=O)ccc1C(=O)N1CCC2(C1)C(=O)Nc1ccccc12
InChIInChI=1S/C19H19N3O3/c1-2-14-12(7-8-16(23)20-14)17(24)22-10-9-19(11-22)13-5-3-4-6-15(13)21-18(19)25/h3-8H,2,9-11H2,1H3,(H,20,23)(H,21,25)
InChIKeyHHSIRRMFTQPFGX-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.67
Rot. Bonds2

About 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one

1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one (PubChem CID 162633325) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
PubChem CID162633325
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
SMILESCCc1[nH]c(=O)ccc1C(=O)N1CCC2(C1)C(=O)Nc1ccccc12
InChIInChI=1S/C19H19N3O3/c1-2-14-12(7-8-16(23)20-14)17(24)22-10-9-19(11-22)13-5-3-4-6-15(13)21-18(19)25/h3-8H,2,9-11H2,1H3,(H,20,23)(H,21,25)
InChIKeyHHSIRRMFTQPFGX-UHFFFAOYSA-N
XLogP1.67
TPSA82.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The IUPAC name of 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one (CID 162633325) is 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The canonical SMILES for 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one is CCc1[nH]c(=O)ccc1C(=O)N1CCC2(C1)C(=O)Nc1ccccc12.
What is the InChIKey of 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The InChIKey is HHSIRRMFTQPFGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-2-14-12(7-8-16(23)20-14)17(24)22-10-9-19(11-22)13-5-3-4-6-15(13)21-18(19)25/h3-8H,2,9-11H2,1H3,(H,20,23)(H,21,25).
What are the key properties of 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one has a molecular weight of 337.38 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(2-ethyl-6-oxo-1H-pyridine-3-carbonyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 162633325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).