2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide

C12H24N4O2 — CID 108994575

IUPAC2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide
SMILESCC(=O)N1CCN(CC(=O)NCCN(C)C)CC1
InChIInChI=1S/C12H24N4O2/c1-11(17)16-8-6-15(7-9-16)10-12(18)13-4-5-14(2)3/h4-10H2,1-3H3,(H,13,18)
InChIKeyOBTOGZRZVKYMHH-UHFFFAOYSA-N
MW256.35 g/mol
LogP-1.17
Rot. Bonds5

About 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide

2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide (PubChem CID 108994575) has the molecular formula C12H24N4O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide.

Molecular Properties

Compound Name2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide
PubChem CID108994575
Molecular FormulaC12H24N4O2
Molecular Weight256.35 g/mol
Exact Mass256.19
IUPAC Name2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide
SMILESCC(=O)N1CCN(CC(=O)NCCN(C)C)CC1
InChIInChI=1S/C12H24N4O2/c1-11(17)16-8-6-15(7-9-16)10-12(18)13-4-5-14(2)3/h4-10H2,1-3H3,(H,13,18)
InChIKeyOBTOGZRZVKYMHH-UHFFFAOYSA-N
XLogP-1.17
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-1.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide?
The IUPAC name of 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide (CID 108994575) is 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide.
What is the SMILES notation for 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide?
The canonical SMILES for 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide is CC(=O)N1CCN(CC(=O)NCCN(C)C)CC1.
What is the InChIKey of 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide?
The InChIKey is OBTOGZRZVKYMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2/c1-11(17)16-8-6-15(7-9-16)10-12(18)13-4-5-14(2)3/h4-10H2,1-3H3,(H,13,18).
What are the key properties of 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide?
2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide has a molecular weight of 256.35 g/mol, XLogP of -1.17, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylpiperazin-1-yl)-N-[2-(dimethylamino)ethyl]acetamide is sourced from PubChem (CID 108994575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).