N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide

C14H19N3O3 — CID 2956602

IUPACN-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide
SMILESCCOc1ccccc1NC(=O)CC1NCCNC1=O
InChIInChI=1S/C14H19N3O3/c1-2-20-12-6-4-3-5-10(12)17-13(18)9-11-14(19)16-8-7-15-11/h3-6,11,15H,2,7-9H2,1H3,(H,16,19)(H,17,18)
InChIKeyFEAVQOFMKJXHBZ-UHFFFAOYSA-N
MW277.32 g/mol
LogP0.50
Rot. Bonds5

About N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide

N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide (PubChem CID 2956602) has the molecular formula C14H19N3O3 and a molecular weight of 277.32 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide
PubChem CID2956602
Molecular FormulaC14H19N3O3
Molecular Weight277.32 g/mol
Exact Mass277.14
IUPAC NameN-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide
SMILESCCOc1ccccc1NC(=O)CC1NCCNC1=O
InChIInChI=1S/C14H19N3O3/c1-2-20-12-6-4-3-5-10(12)17-13(18)9-11-14(19)16-8-7-15-11/h3-6,11,15H,2,7-9H2,1H3,(H,16,19)(H,17,18)
InChIKeyFEAVQOFMKJXHBZ-UHFFFAOYSA-N
XLogP0.50
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 50.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-Methoxyphenyl)piperazine
CID 1346
o-Ethoxyacetanilide
CID 11383
1-(2-Ethoxyphenyl)piperazine
CID 83357
3,4-Dihydro-2H-1,4-benzoxazine-2-carboxamide
CID 26120
1-[2-(Propan-2-yloxy)phenyl]piperazine
CID 10944016
Rwj-69736
CID 9866614
Propetamide
CID 68937
Acetamide, N-(4-(3-(4-(2-methoxyphenyl)-1-piperazinyl)propoxy)phenyl)-
CID 55421
N-(2-methoxyphenyl)-2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamide
CID 2834475
1-(2-Ethoxy-phenyl)-3-(hydroxy-phenyl-amino)-pyrrolidine-2,5-dione
CID 2856113
1-(4-(4-(2-Methoxyphenyl)-1-piperazinyl)butyl)-2,5-pyrrolidinedione
CID 3994476
Rwj-38063
CID 9887378

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The IUPAC name of N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide (CID 2956602) is N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide is CCOc1ccccc1NC(=O)CC1NCCNC1=O.
What is the InChIKey of N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
The InChIKey is FEAVQOFMKJXHBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O3/c1-2-20-12-6-4-3-5-10(12)17-13(18)9-11-14(19)16-8-7-15-11/h3-6,11,15H,2,7-9H2,1H3,(H,16,19)(H,17,18).
What are the key properties of N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide?
N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide has a molecular weight of 277.32 g/mol, XLogP of 0.50, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2-(3-oxopiperazin-2-yl)acetamide is sourced from PubChem (CID 2956602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).