N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide

C15H21N3O3 — CID 28708780

IUPACN-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide
SMILESO=C(CCOc1ccccc1)NCC(=O)N1CCNCC1
InChIInChI=1S/C15H21N3O3/c19-14(6-11-21-13-4-2-1-3-5-13)17-12-15(20)18-9-7-16-8-10-18/h1-5,16H,6-12H2,(H,17,19)
InChIKeyHIMNOYKBJWYSPO-UHFFFAOYSA-N
MW291.35 g/mol
LogP0.00
Rot. Bonds6

About N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide

N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide (PubChem CID 28708780) has the molecular formula C15H21N3O3 and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide.

Molecular Properties

Compound NameN-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide
PubChem CID28708780
Molecular FormulaC15H21N3O3
Molecular Weight291.35 g/mol
Exact Mass291.16
IUPAC NameN-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide
SMILESO=C(CCOc1ccccc1)NCC(=O)N1CCNCC1
InChIInChI=1S/C15H21N3O3/c19-14(6-11-21-13-4-2-1-3-5-13)17-12-15(20)18-9-7-16-8-10-18/h1-5,16H,6-12H2,(H,17,19)
InChIKeyHIMNOYKBJWYSPO-UHFFFAOYSA-N
XLogP0.00
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 ≤ 50.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide
CID 28708779
N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride
CID 119402544
4-phenoxy-1-[4-(3-phenoxypropanoyl)piperazin-1-yl]butan-1-one
CID 108536243
N-[3-(4-ethylpiperazin-1-yl)-3-oxopropyl]-3-phenoxypropanamide
CID 110287178
3-phenoxy-1-(4-propanoylpiperazin-1-yl)propan-1-one
CID 110817115
3-(4-fluorophenoxy)-1-piperazin-1-ylpropan-1-one
CID 39256403
1-(4-benzoylpiperazin-1-yl)-3-phenoxypropan-1-one
CID 112507736
3-(3-hydroxyphenoxy)-1-piperazin-1-ylpropan-1-one
CID 2759326
N-(2-oxo-2-piperazin-1-ylethyl)-2-pyridin-2-ylacetamide
CID 61174926
1-[4-(2-chlorophenyl)piperazin-1-yl]-3-phenoxypropan-1-one
CID 25130950
3-phenoxy-1-[4-[(E)-3-phenylprop-2-enoyl]piperazin-1-yl]propan-1-one
CID 108569437
N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2-phenoxyacetamide
CID 7779440

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide?
The IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide (CID 28708780) is N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide.
What is the SMILES notation for N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide?
The canonical SMILES for N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide is O=C(CCOc1ccccc1)NCC(=O)N1CCNCC1.
What is the InChIKey of N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide?
The InChIKey is HIMNOYKBJWYSPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O3/c19-14(6-11-21-13-4-2-1-3-5-13)17-12-15(20)18-9-7-16-8-10-18/h1-5,16H,6-12H2,(H,17,19).
What are the key properties of N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide?
N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide has a molecular weight of 291.35 g/mol, XLogP of 0.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-2-piperazin-1-ylethyl)-3-phenoxypropanamide is sourced from PubChem (CID 28708780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).