1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one

C21H23N5O2 — CID 135116488

IUPAC1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one
SMILESO=C(c1cncc(N2CCC3(CC2)C(=O)Nc2ccccc23)n1)N1CCCC1
InChIInChI=1S/C21H23N5O2/c27-19(26-9-3-4-10-26)17-13-22-14-18(23-17)25-11-7-21(8-12-25)15-5-1-2-6-16(15)24-20(21)28/h1-2,5-6,13-14H,3-4,7-12H2,(H,24,28)
InChIKeyNTSAQSBXMSUUQA-UHFFFAOYSA-N
MW377.45 g/mol
LogP2.20
Rot. Bonds2

About 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one

1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one (PubChem CID 135116488) has the molecular formula C21H23N5O2 and a molecular weight of 377.45 g/mol. Its IUPAC name is 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one.

Molecular Properties

Compound Name1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one
PubChem CID135116488
Molecular FormulaC21H23N5O2
Molecular Weight377.45 g/mol
Exact Mass377.19
IUPAC Name1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one
SMILESO=C(c1cncc(N2CCC3(CC2)C(=O)Nc2ccccc23)n1)N1CCCC1
InChIInChI=1S/C21H23N5O2/c27-19(26-9-3-4-10-26)17-13-22-14-18(23-17)25-11-7-21(8-12-25)15-5-1-2-6-16(15)24-20(21)28/h1-2,5-6,13-14H,3-4,7-12H2,(H,24,28)
InChIKeyNTSAQSBXMSUUQA-UHFFFAOYSA-N
XLogP2.20
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.45
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1'-(pyridine-3-carbonyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 97375619
[6-[3-hydroxy-3-(2-methylphenyl)pyrrolidin-1-yl]pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 135116874
piperidin-1-yl-(6-piperidin-1-ylpyrazin-2-yl)methanone
CID 165345728
2-(dimethylamino)-8-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]-1,3,8-triazaspiro[4.5]dec-1-en-4-one
CID 135100603
5-(2-oxospiro[1H-indole-3,4'-piperidine]-1'-carbonyl)pyridine-2-carbonitrile
CID 56896844
1'-(4-chlorobenzoyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 56892371
2-(2-phenylethyl)-7-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]-2,7-diazaspiro[4.4]nonan-1-one
CID 175645650
1'-(5,7-dimethylpyrazolo[1,5-a]pyrimidine-2-carbonyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 56896792
8-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]-2,8-diazaspiro[4.5]decane-3-carboxylic acid
CID 56915366
1'-(6-chloropyridazin-3-yl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 155536718
2-(2-oxospiro[1H-indole-3,4'-piperidine]-1'-yl)quinoline-4-carboxamide;hydrochloride
CID 154888897
[6-(1-oxa-4,9-diazaspiro[5.5]undecan-4-yl)pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 135097694

Frequently Asked Questions

What is the IUPAC name of 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one?
The IUPAC name of 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one (CID 135116488) is 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one.
What is the SMILES notation for 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one?
The canonical SMILES for 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one is O=C(c1cncc(N2CCC3(CC2)C(=O)Nc2ccccc23)n1)N1CCCC1.
What is the InChIKey of 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one?
The InChIKey is NTSAQSBXMSUUQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N5O2/c27-19(26-9-3-4-10-26)17-13-22-14-18(23-17)25-11-7-21(8-12-25)15-5-1-2-6-16(15)24-20(21)28/h1-2,5-6,13-14H,3-4,7-12H2,(H,24,28).
What are the key properties of 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one?
1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one has a molecular weight of 377.45 g/mol, XLogP of 2.20, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-[6-(pyrrolidine-1-carbonyl)pyrazin-2-yl]spiro[1H-indole-3,4'-piperidine]-2-one is sourced from PubChem (CID 135116488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).