3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide

C24H28N4O3 — CID 51112972

IUPAC3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide
SMILESNC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2ccc(N3CCCCC3=O)cc2)c1
InChIInChI=1S/C24H28N4O3/c25-23(30)18-9-12-21(27-13-3-1-4-14-27)20(16-18)26-24(31)17-7-10-19(11-8-17)28-15-5-2-6-22(28)29/h7-12,16H,1-6,13-15H2,(H2,25,30)(H,26,31)
InChIKeyYIYFFEQJGUPWSW-UHFFFAOYSA-N
MW420.51 g/mol
LogP3.55
Rot. Bonds5

About 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide

3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide (PubChem CID 51112972) has the molecular formula C24H28N4O3 and a molecular weight of 420.51 g/mol. Its IUPAC name is 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide.

Molecular Properties

Compound Name3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide
PubChem CID51112972
Molecular FormulaC24H28N4O3
Molecular Weight420.51 g/mol
Exact Mass420.22
IUPAC Name3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide
SMILESNC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2ccc(N3CCCCC3=O)cc2)c1
InChIInChI=1S/C24H28N4O3/c25-23(30)18-9-12-21(27-13-3-1-4-14-27)20(16-18)26-24(31)17-7-10-19(11-8-17)28-15-5-2-6-22(28)29/h7-12,16H,1-6,13-15H2,(H2,25,30)(H,26,31)
InChIKeyYIYFFEQJGUPWSW-UHFFFAOYSA-N
XLogP3.55
TPSA95.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.51
LogP ≤ 53.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-pyrrolidin-1-ylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 134044794
3-[(4-methylbenzoyl)amino]-4-pyrrolidin-1-ylbenzamide
CID 17470127
3-[[2-[3-(2-oxopyrrolidin-1-yl)phenoxy]acetyl]amino]-4-piperidin-1-ylbenzamide
CID 24675926
4-(2-oxopyrrolidin-1-yl)-N-(4-piperidin-1-ylphenyl)benzamide
CID 7922377
5-bromo-N-(5-carbamoyl-2-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 24632177
N-(2,5-dimethylphenyl)-4-(2-oxopiperidin-1-yl)benzamide
CID 36675659
N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-oxopiperidin-1-yl)benzamide
CID 18204867
N-(5-carbamoyl-2-pyrrolidin-1-ylphenyl)-5-cyclohexylfuran-2-carboxamide
CID 167756186
4-(2,5-dioxopyrrolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 16557741
N-(5-carbamoyl-2-pyrrolidin-1-ylphenyl)-2,4-dimethylbenzamide
CID 30218966
N-(5-amino-2-piperidin-1-ylphenyl)-4-ethylbenzamide
CID 91675436
4-(carbamoylamino)-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 26127679

Frequently Asked Questions

What is the IUPAC name of 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide?
The IUPAC name of 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide (CID 51112972) is 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide.
What is the SMILES notation for 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide?
The canonical SMILES for 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide is NC(=O)c1ccc(N2CCCCC2)c(NC(=O)c2ccc(N3CCCCC3=O)cc2)c1.
What is the InChIKey of 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide?
The InChIKey is YIYFFEQJGUPWSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O3/c25-23(30)18-9-12-21(27-13-3-1-4-14-27)20(16-18)26-24(31)17-7-10-19(11-8-17)28-15-5-2-6-22(28)29/h7-12,16H,1-6,13-15H2,(H2,25,30)(H,26,31).
What are the key properties of 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide?
3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide has a molecular weight of 420.51 g/mol, XLogP of 3.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(2-oxopiperidin-1-yl)benzoyl]amino]-4-piperidin-1-ylbenzamide is sourced from PubChem (CID 51112972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).