N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide

C15H21N3O3 — CID 166586198

IUPACN-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide
SMILESO=C(NCCOCC(=O)N1CCNCC1)c1ccccc1
InChIInChI=1S/C15H21N3O3/c19-14(18-9-6-16-7-10-18)12-21-11-8-17-15(20)13-4-2-1-3-5-13/h1-5,16H,6-12H2,(H,17,20)
InChIKeyNBASQKIUJXVWIQ-UHFFFAOYSA-N
MW291.35 g/mol
LogP-0.14
Rot. Bonds6

About N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide

N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide (PubChem CID 166586198) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide.

Molecular Properties

Compound NameN-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide
PubChem CID166586198
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC NameN-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide
SMILESO=C(NCCOCC(=O)N1CCNCC1)c1ccccc1
InChIInChI=1S/C15H21N3O3/c19-14(18-9-6-16-7-10-18)12-21-11-8-17-15(20)13-4-2-1-3-5-13/h1-5,16H,6-12H2,(H,17,20)
InChIKeyNBASQKIUJXVWIQ-UHFFFAOYSA-N
XLogP-0.14
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(1,4-diazepan-1-yl)-4-oxobutyl]benzamide
CID 119418551
N-(3-oxo-3-piperidin-1-ylpropyl)benzamide
CID 17154515
N-(3-oxo-3-piperazin-1-ylpropyl)pyridine-3-carboxamide
CID 28709234
3-methyl-N-(3-oxo-3-piperazin-1-ylpropyl)benzamide
CID 28709214
N-[2-[2-(methylamino)ethoxy]ethyl]benzamide
CID 166579726
bis(3-benzamidopropanoic acid);piperazine
CID 3045072
2-chloro-N-(3-oxo-3-piperazin-1-ylpropyl)benzamide
CID 28709231
4-benzoyl-N-(3-oxo-3-pyrrolidin-1-ylpropyl)benzamide
CID 18157014
N-(3-oxo-1-phenyl-3-piperazin-1-ylpropyl)benzamide
CID 119401596
N-[2-[2-(2-chloroethoxy)ethoxy]ethyl]benzamide
CID 126723293
N-[2-[(1,3-diphenyl-1,3,2-diazaphospholidin-2-yl)oxy]ethyl]benzamide
CID 118949792
2-[2-[(4-fluorobenzoyl)amino]ethoxy]acetic acid
CID 79456610

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide?
The IUPAC name of N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide (CID 166586198) is N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide.
What is the SMILES notation for N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide?
The canonical SMILES for N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide is O=C(NCCOCC(=O)N1CCNCC1)c1ccccc1.
What is the InChIKey of N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide?
The InChIKey is NBASQKIUJXVWIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c19-14(18-9-6-16-7-10-18)12-21-11-8-17-15(20)13-4-2-1-3-5-13/h1-5,16H,6-12H2,(H,17,20).
What are the key properties of N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide?
N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide has a molecular weight of 291.35 g/mol, XLogP of -0.14, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-oxo-2-piperazin-1-ylethoxy)ethyl]benzamide is sourced from PubChem (CID 166586198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).