N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride

C14H20ClN3O3 — CID 119402544

IUPACN-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride
SMILESCl.O=C(COc1ccccc1)NCC(=O)N1CCNCC1
InChIInChI=1S/C14H19N3O3.ClH/c18-13(11-20-12-4-2-1-3-5-12)16-10-14(19)17-8-6-15-7-9-17;/h1-5,15H,6-11H2,(H,16,18);1H
InChIKeyWUGNGHGWDCPEFT-UHFFFAOYSA-N
MW313.78 g/mol
LogP0.04
Rot. Bonds5

About N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride

N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride (PubChem CID 119402544) has the molecular formula C14H20ClN3O3 and a molecular weight of 313.78 g/mol. Its IUPAC name is N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride.

Molecular Properties

Compound NameN-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride
PubChem CID119402544
Molecular FormulaC14H20ClN3O3
Molecular Weight313.78 g/mol
Exact Mass313.12
IUPAC NameN-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride
SMILESCl.O=C(COc1ccccc1)NCC(=O)N1CCNCC1
InChIInChI=1S/C14H19N3O3.ClH/c18-13(11-20-12-4-2-1-3-5-12)16-10-14(19)17-8-6-15-7-9-17;/h1-5,15H,6-11H2,(H,16,18);1H
InChIKeyWUGNGHGWDCPEFT-UHFFFAOYSA-N
XLogP0.04
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.78
LogP ≤ 50.04
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)-3-phenoxypropanamide
CID 28708780
4-hydroxy-1-[2-[(2-phenoxyacetyl)amino]acetyl]piperidine-4-carboxylic acid
CID 120528193
N-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-2-phenoxyacetamide
CID 7779440
2-[(2-phenoxyacetyl)amino]-N-(2-piperazin-1-ylethyl)acetamide
CID 119447721
methyl 1-[2-[(2-phenoxyacetyl)amino]acetyl]piperidine-4-carboxylate
CID 51166518
N-[1-[2-[(2-phenoxyacetyl)amino]acetyl]piperidin-4-yl]benzamide
CID 17432373
N-[2-[4-[(4-cyanophenyl)methyl]piperazin-1-yl]-2-oxoethyl]-2-phenoxyacetamide
CID 27755996
N-[2-[4-[2-hydroxyethyl(methyl)amino]piperidin-1-yl]-2-oxoethyl]-2-phenoxyacetamide
CID 75448434
N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]-2-phenoxyacetamide
CID 7494425
N-[2-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-oxoethyl]-2-phenoxyacetamide
CID 7661767
N-[2-oxo-2-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]ethyl]-2-phenoxyacetamide
CID 9226163

Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride?
The IUPAC name of N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride (CID 119402544) is N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride.
What is the SMILES notation for N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride?
The canonical SMILES for N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride is Cl.O=C(COc1ccccc1)NCC(=O)N1CCNCC1.
What is the InChIKey of N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride?
The InChIKey is WUGNGHGWDCPEFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3.ClH/c18-13(11-20-12-4-2-1-3-5-12)16-10-14(19)17-8-6-15-7-9-17;/h1-5,15H,6-11H2,(H,16,18);1H.
What are the key properties of N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride?
N-(2-oxo-2-piperazin-1-ylethyl)-2-phenoxyacetamide;hydrochloride has a molecular weight of 313.78 g/mol, XLogP of 0.04, 5 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)-2-phenoxyacetamide;hydrochloride is sourced from PubChem (CID 119402544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).