2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide

C27H25N5O3 — CID 44570421

IUPAC2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide
SMILESO=C(Cn1c(=O)n(-c2ccccn2)c2ccccc21)Nc1ccc2c(c1)CC1(CCCNC1=O)C2
InChIInChI=1S/C27H25N5O3/c33-24(30-20-10-9-18-15-27(16-19(18)14-20)11-5-13-29-25(27)34)17-31-21-6-1-2-7-22(21)32(26(31)35)23-8-3-4-12-28-23/h1-4,6-10,12,14H,5,11,13,15-17H2,(H,29,34)(H,30,33)
InChIKeyVWZIOWLDVZYZAC-UHFFFAOYSA-N
MW467.53 g/mol
LogP2.82
Rot. Bonds4

About 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide

2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide (PubChem CID 44570421) has the molecular formula C27H25N5O3 and a molecular weight of 467.53 g/mol. Its IUPAC name is 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide
PubChem CID44570421
Molecular FormulaC27H25N5O3
Molecular Weight467.53 g/mol
Exact Mass467.20
IUPAC Name2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide
SMILESO=C(Cn1c(=O)n(-c2ccccn2)c2ccccc21)Nc1ccc2c(c1)CC1(CCCNC1=O)C2
InChIInChI=1S/C27H25N5O3/c33-24(30-20-10-9-18-15-27(16-19(18)14-20)11-5-13-29-25(27)34)17-31-21-6-1-2-7-22(21)32(26(31)35)23-8-3-4-12-28-23/h1-4,6-10,12,14H,5,11,13,15-17H2,(H,29,34)(H,30,33)
InChIKeyVWZIOWLDVZYZAC-UHFFFAOYSA-N
XLogP2.82
TPSA98.02 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.53
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5'-oxo-2'-phenylspiro[1,3-dihydroindene-2,4'-1H-imidazole]-5-yl)-2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)acetamide
CID 45254663
N-(1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl)-2-(2-oxo-3-pyrimidin-5-ylbenzimidazol-1-yl)acetamide
CID 10413017
4-[3-[2-[[(2R)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]amino]-2-oxoethyl]-2-oxobenzimidazol-1-yl]butanamide
CID 44563126
2-[3-(1,1-dioxothiolan-3-yl)-2-oxobenzimidazol-1-yl]-N-(1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl)acetamide
CID 10006995
2-(3-methyl-2-oxobenzimidazol-1-yl)-N-pyridin-2-ylacetamide
CID 18142520
N-(2',5'-dioxospiro[1,3-dihydroindene-2,4'-imidazolidine]-5-yl)-2-indol-1-ylacetamide
CID 10429483
2-(benzimidazol-1-yl)-N-(1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl)acetamide
CID 10430413
2-(3-oxo-2-phenyl-1,4-diazaspiro[4.6]undec-1-en-4-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide
CID 58553946
2-(2,10-dioxo-1,3,9-triazatricyclo[6.3.1.04,12]dodeca-4,6,8(12)-trien-3-yl)-N-(1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl)acetamide
CID 11633991
2-(7-methoxy-2,10-dioxo-1,3,9-triazatricyclo[6.3.1.04,12]dodeca-4(12),5,7-trien-3-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-1H-pyrrolo[2,3-b]pyridine]-5-yl)acetamide
CID 11533571
N-[(2R)-1'-methyl-2',4'-dioxospiro[1,3-dihydroindene-2,5'-imidazolidine]-5-yl]-2-(9-methyl-2,10-dioxo-1,3,9-triazatricyclo[6.5.1.04,14]tetradeca-4(14),5,7-trien-3-yl)acetamide
CID 44563200
2-(9-methyl-2,10-dioxo-1,3,9-triazatricyclo[6.3.1.04,12]dodeca-4(12),5,7-trien-3-yl)-N-(6'-oxospiro[1,3-dihydroindene-2,5'-7H-pyrrolo[2,3-d]pyrimidine]-5-yl)acetamide
CID 11720196

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide?
The IUPAC name of 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide (CID 44570421) is 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide.
What is the SMILES notation for 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide?
The canonical SMILES for 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide is O=C(Cn1c(=O)n(-c2ccccn2)c2ccccc21)Nc1ccc2c(c1)CC1(CCCNC1=O)C2.
What is the InChIKey of 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide?
The InChIKey is VWZIOWLDVZYZAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25N5O3/c33-24(30-20-10-9-18-15-27(16-19(18)14-20)11-5-13-29-25(27)34)17-31-21-6-1-2-7-22(21)32(26(31)35)23-8-3-4-12-28-23/h1-4,6-10,12,14H,5,11,13,15-17H2,(H,29,34)(H,30,33).
What are the key properties of 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide?
2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide has a molecular weight of 467.53 g/mol, XLogP of 2.82, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-3-pyridin-2-ylbenzimidazol-1-yl)-N-(2'-oxospiro[1,3-dihydroindene-2,3'-piperidine]-5-yl)acetamide is sourced from PubChem (CID 44570421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).