2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone

C12H24N4O2 — CID 56688517

IUPAC2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone
SMILESCN(C)CC(=O)N1CCN(C(=O)CN(C)C)CC1
InChIInChI=1S/C12H24N4O2/c1-13(2)9-11(17)15-5-7-16(8-6-15)12(18)10-14(3)4/h5-10H2,1-4H3
InChIKeyVYYNKSFJPUHVNE-UHFFFAOYSA-N
MW256.35 g/mol
LogP-1.22
Rot. Bonds4

About 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone

2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone (PubChem CID 56688517) has the molecular formula C12H24N4O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone.

Molecular Properties

Compound Name2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone
PubChem CID56688517
Molecular FormulaC12H24N4O2
Molecular Weight256.35 g/mol
Exact Mass256.19
IUPAC Name2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone
SMILESCN(C)CC(=O)N1CCN(C(=O)CN(C)C)CC1
InChIInChI=1S/C12H24N4O2/c1-13(2)9-11(17)15-5-7-16(8-6-15)12(18)10-14(3)4/h5-10H2,1-4H3
InChIKeyVYYNKSFJPUHVNE-UHFFFAOYSA-N
XLogP-1.22
TPSA47.10 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-1.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone 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-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone?
The IUPAC name of 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone (CID 56688517) is 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone.
What is the SMILES notation for 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone?
The canonical SMILES for 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone is CN(C)CC(=O)N1CCN(C(=O)CN(C)C)CC1.
What is the InChIKey of 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone?
The InChIKey is VYYNKSFJPUHVNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2/c1-13(2)9-11(17)15-5-7-16(8-6-15)12(18)10-14(3)4/h5-10H2,1-4H3.
What are the key properties of 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone?
2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone has a molecular weight of 256.35 g/mol, XLogP of -1.22, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-[4-[2-(dimethylamino)acetyl]piperazin-1-yl]ethanone is sourced from PubChem (CID 56688517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).