2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide

C13H20N4O — CID 54943649

IUPAC2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide
SMILESO=C(CN1CCNCC1)NCCc1ccncc1
InChIInChI=1S/C13H20N4O/c18-13(11-17-9-7-15-8-10-17)16-6-3-12-1-4-14-5-2-12/h1-2,4-5,15H,3,6-11H2,(H,16,18)
InChIKeyGFAJIRUTGPVTFE-UHFFFAOYSA-N
MW248.33 g/mol
LogP-0.35
Rot. Bonds5

About 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide

2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide (PubChem CID 54943649) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide.

Molecular Properties

Compound Name2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide
PubChem CID54943649
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide
SMILESO=C(CN1CCNCC1)NCCc1ccncc1
InChIInChI=1S/C13H20N4O/c18-13(11-17-9-7-15-8-10-17)16-6-3-12-1-4-14-5-2-12/h1-2,4-5,15H,3,6-11H2,(H,16,18)
InChIKeyGFAJIRUTGPVTFE-UHFFFAOYSA-N
XLogP-0.35
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 5-0.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)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-(1,4-diazepan-1-yl)-N-(2-pyridin-4-ylethyl)acetamide
CID 55123139
N-[2-(4-chlorophenyl)ethyl]-2-piperazin-1-ylacetamide;hydrochloride
CID 17221281
2-(1,4-diazepan-1-yl)-N-[2-(4-hydroxyphenyl)ethyl]acetamide
CID 62839241
2-(1,4-diazepan-1-yl)-N-[2-(3,5-difluorophenyl)ethyl]acetamide
CID 62832012
2-(1,4-diazepan-1-yl)-N-[2-(1-methylpyrazol-4-yl)ethyl]acetamide
CID 80682467
N-[2-(2-fluorophenyl)ethyl]-2-piperazin-1-ylacetamide
CID 28505813
N-[2-(5-chlorothiophen-2-yl)ethyl]-2-piperazin-1-ylacetamide
CID 106047885
1-[2-oxo-2-(2-pyridin-4-ylethylamino)ethyl]pyrrole-2-carboxylic acid
CID 79325040
N-[2-(3-chlorophenyl)ethyl]-2-(1,4-diazepan-1-yl)acetamide
CID 43348758
2-hydroxy-N-(2-pyridin-4-ylethyl)acetamide
CID 83816903
2-(azepan-1-yl)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 644372
2-(1,4-diazepan-1-yl)-N-[2-(1-methylpyrazol-3-yl)ethyl]acetamide
CID 106105029

Frequently Asked Questions

What is the IUPAC name of 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide?
The IUPAC name of 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide (CID 54943649) is 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide.
What is the SMILES notation for 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide?
The canonical SMILES for 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide is O=C(CN1CCNCC1)NCCc1ccncc1.
What is the InChIKey of 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide?
The InChIKey is GFAJIRUTGPVTFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c18-13(11-17-9-7-15-8-10-17)16-6-3-12-1-4-14-5-2-12/h1-2,4-5,15H,3,6-11H2,(H,16,18).
What are the key properties of 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide?
2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide has a molecular weight of 248.33 g/mol, XLogP of -0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-N-(2-pyridin-4-ylethyl)acetamide is sourced from PubChem (CID 54943649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).