2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide

C14H26N4O2 — CID 64979203

IUPAC2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide
SMILESC=CCNC(=O)NC(=O)CN1CC(CC)NCC1CC
InChIInChI=1S/C14H26N4O2/c1-4-7-15-14(20)17-13(19)10-18-9-11(5-2)16-8-12(18)6-3/h4,11-12,16H,1,5-10H2,2-3H3,(H2,15,17,19,20)
InChIKeyOEKYYJFZUZUVHI-UHFFFAOYSA-N
MW282.39 g/mol
LogP0.46
Rot. Bonds6

About 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide

2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide (PubChem CID 64979203) has the molecular formula C14H26N4O2 and a molecular weight of 282.39 g/mol. Its IUPAC name is 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide.

Molecular Properties

Compound Name2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide
PubChem CID64979203
Molecular FormulaC14H26N4O2
Molecular Weight282.39 g/mol
Exact Mass282.21
IUPAC Name2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide
SMILESC=CCNC(=O)NC(=O)CN1CC(CC)NCC1CC
InChIInChI=1S/C14H26N4O2/c1-4-7-15-14(20)17-13(19)10-18-9-11(5-2)16-8-12(18)6-3/h4,11-12,16H,1,5-10H2,2-3H3,(H2,15,17,19,20)
InChIKeyOEKYYJFZUZUVHI-UHFFFAOYSA-N
XLogP0.46
TPSA73.47 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 50.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide 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

2-(2-methylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide;hydrochloride
CID 119916484
1-(2-bromoprop-2-enyl)-2,5-diethylpiperazine
CID 64978694
2-(2,5-diethylpiperazin-1-yl)-N-(3-ethylpent-1-yn-3-yl)acetamide
CID 64979190
2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(prop-2-enylcarbamoyl)acetamide
CID 62014153
1-(3-chloro-2-methylprop-2-enyl)-2,5-diethylpiperazine
CID 106439468
2-methyl-1-[2-oxo-2-(prop-2-enylcarbamoylamino)ethyl]pyrrolidine-3-carboxylic acid
CID 79370158
N-(2-bromophenyl)-2-(2,5-diethylpiperazin-1-yl)acetamide
CID 64978706
2-[4-[2-(ethylcarbamoylamino)-2-oxoethyl]piperazin-1-yl]-N-prop-2-enylacetamide
CID 30967520
2-(4,4-dimethyl-1,2,3,3a,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl)-N-(prop-2-enylcarbamoyl)acetamide
CID 66244631
2-[2-(hydroxymethyl)azepan-1-yl]-N-(prop-2-enylcarbamoyl)acetamide
CID 116637853
3-(2,5-diethylpiperazin-1-yl)propanoic acid
CID 64978721
2-[2-(aminomethyl)piperidin-1-yl]-N-(prop-2-enylcarbamoyl)acetamide;hydrochloride
CID 119916141

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide?
The IUPAC name of 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide (CID 64979203) is 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide.
What is the SMILES notation for 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide?
The canonical SMILES for 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide is C=CCNC(=O)NC(=O)CN1CC(CC)NCC1CC.
What is the InChIKey of 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide?
The InChIKey is OEKYYJFZUZUVHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O2/c1-4-7-15-14(20)17-13(19)10-18-9-11(5-2)16-8-12(18)6-3/h4,11-12,16H,1,5-10H2,2-3H3,(H2,15,17,19,20).
What are the key properties of 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide?
2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide has a molecular weight of 282.39 g/mol, XLogP of 0.46, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-diethylpiperazin-1-yl)-N-(prop-2-enylcarbamoyl)acetamide is sourced from PubChem (CID 64979203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).