1-(4-ethylpiperazin-1-yl)-2-phenylethanone

C14H20N2O — CID 3328378

IUPAC1-(4-ethylpiperazin-1-yl)-2-phenylethanone
SMILESCCN1CCN(C(=O)Cc2ccccc2)CC1
InChIInChI=1S/C14H20N2O/c1-2-15-8-10-16(11-9-15)14(17)12-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3
InChIKeyZKLSFAKJJJDQSA-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.39
Rot. Bonds3

About 1-(4-ethylpiperazin-1-yl)-2-phenylethanone

1-(4-ethylpiperazin-1-yl)-2-phenylethanone (PubChem CID 3328378) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 1-(4-ethylpiperazin-1-yl)-2-phenylethanone.

Molecular Properties

Compound Name1-(4-ethylpiperazin-1-yl)-2-phenylethanone
PubChem CID3328378
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name1-(4-ethylpiperazin-1-yl)-2-phenylethanone
SMILESCCN1CCN(C(=O)Cc2ccccc2)CC1
InChIInChI=1S/C14H20N2O/c1-2-15-8-10-16(11-9-15)14(17)12-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3
InChIKeyZKLSFAKJJJDQSA-UHFFFAOYSA-N
XLogP1.39
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-ethylpiperazin-1-yl)-2-phenylethanone 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 1-(4-ethylpiperazin-1-yl)-2-phenylethanone?
The IUPAC name of 1-(4-ethylpiperazin-1-yl)-2-phenylethanone (CID 3328378) is 1-(4-ethylpiperazin-1-yl)-2-phenylethanone.
What is the SMILES notation for 1-(4-ethylpiperazin-1-yl)-2-phenylethanone?
The canonical SMILES for 1-(4-ethylpiperazin-1-yl)-2-phenylethanone is CCN1CCN(C(=O)Cc2ccccc2)CC1.
What is the InChIKey of 1-(4-ethylpiperazin-1-yl)-2-phenylethanone?
The InChIKey is ZKLSFAKJJJDQSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-15-8-10-16(11-9-15)14(17)12-13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3.
What are the key properties of 1-(4-ethylpiperazin-1-yl)-2-phenylethanone?
1-(4-ethylpiperazin-1-yl)-2-phenylethanone has a molecular weight of 232.33 g/mol, XLogP of 1.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylpiperazin-1-yl)-2-phenylethanone is sourced from PubChem (CID 3328378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).