N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide

C20H28N4O3 — CID 35615572

IUPACN-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
SMILESO=C(NCC(=O)N1CCN(CC(=O)N2CCCCC2)CC1)c1ccccc1
InChIInChI=1S/C20H28N4O3/c25-18(15-21-20(27)17-7-3-1-4-8-17)24-13-11-22(12-14-24)16-19(26)23-9-5-2-6-10-23/h1,3-4,7-8H,2,5-6,9-16H2,(H,21,27)
InChIKeyKTOVGSJVJHCDDA-UHFFFAOYSA-N
MW372.47 g/mol
LogP0.57
Rot. Bonds5

About N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide

N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide (PubChem CID 35615572) has the molecular formula C20H28N4O3 and a molecular weight of 372.47 g/mol. Its IUPAC name is N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide.

Molecular Properties

Compound NameN-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
PubChem CID35615572
Molecular FormulaC20H28N4O3
Molecular Weight372.47 g/mol
Exact Mass372.22
IUPAC NameN-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
SMILESO=C(NCC(=O)N1CCN(CC(=O)N2CCCCC2)CC1)c1ccccc1
InChIInChI=1S/C20H28N4O3/c25-18(15-21-20(27)17-7-3-1-4-8-17)24-13-11-22(12-14-24)16-19(26)23-9-5-2-6-10-23/h1,3-4,7-8H,2,5-6,9-16H2,(H,21,27)
InChIKeyKTOVGSJVJHCDDA-UHFFFAOYSA-N
XLogP0.57
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
CID 30543562
2-chloro-N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
CID 30543359
2-methyl-N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
CID 46523795
2-fluoro-N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide
CID 43045470
N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]benzamide
CID 2095623
N-[2-[4-(cyclohexanecarbonyl)piperazin-1-yl]-2-oxoethyl]benzamide
CID 110801022
N-[2-(4-benzoylpiperazin-1-yl)-2-oxoethyl]benzamide
CID 2560876
N-[2-oxo-2-[4-(3,3,3-trifluoropropyl)-1,4-diazepan-1-yl]ethyl]benzamide
CID 134711635
N-[2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-2-oxoethyl]-N-methylbenzamide
CID 55567018
1-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-1-yl]-3,3-diphenylpropan-1-one
CID 35610560
N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 17154515
N-[2-[4-(4-methylbenzoyl)-1,4-diazepan-1-yl]-2-oxoethyl]benzamide
CID 108543980

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide?
The IUPAC name of N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide (CID 35615572) is N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide.
What is the SMILES notation for N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide?
The canonical SMILES for N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide is O=C(NCC(=O)N1CCN(CC(=O)N2CCCCC2)CC1)c1ccccc1.
What is the InChIKey of N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide?
The InChIKey is KTOVGSJVJHCDDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O3/c25-18(15-21-20(27)17-7-3-1-4-8-17)24-13-11-22(12-14-24)16-19(26)23-9-5-2-6-10-23/h1,3-4,7-8H,2,5-6,9-16H2,(H,21,27).
What are the key properties of N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide?
N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide has a molecular weight of 372.47 g/mol, XLogP of 0.57, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]ethyl]benzamide is sourced from PubChem (CID 35615572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).