2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide

C14H23N4O2+ — CID 7060420

IUPAC2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide
SMILESCCOc1ccccc1N1CC[NH+](CC(=O)NN)CC1
InChIInChI=1S/C14H22N4O2/c1-2-20-13-6-4-3-5-12(13)18-9-7-17(8-10-18)11-14(19)16-15/h3-6H,2,7-11,15H2,1H3,(H,16,19)/p+1
InChIKeyWGPQKHCWNCNAFS-UHFFFAOYSA-O
MW279.36 g/mol
LogP-1.22
Rot. Bonds5

About 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide

2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide (PubChem CID 7060420) has the molecular formula C14H23N4O2+ and a molecular weight of 279.36 g/mol. Its IUPAC name is 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide.

Molecular Properties

Compound Name2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide
PubChem CID7060420
Molecular FormulaC14H23N4O2+
Molecular Weight279.36 g/mol
Exact Mass279.18
IUPAC Name2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide
SMILESCCOc1ccccc1N1CC[NH+](CC(=O)NN)CC1
InChIInChI=1S/C14H22N4O2/c1-2-20-13-6-4-3-5-12(13)18-9-7-17(8-10-18)11-14(19)16-15/h3-6H,2,7-11,15H2,1H3,(H,16,19)/p+1
InChIKeyWGPQKHCWNCNAFS-UHFFFAOYSA-O
XLogP-1.22
TPSA72.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 5-1.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide 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

N-(4-ethoxyphenyl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide
CID 8703710
2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 8691425
2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-(2-phenylsulfanylethyl)acetamide
CID 9027893
2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-N-[(1R)-1-(4-methylphenyl)propyl]acetamide
CID 8703554
N-(1,3-benzodioxol-5-yl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide
CID 2161884
2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]-1-(4-phenylpiperazin-1-yl)ethanone
CID 9346325
N-(3-cyanothiophen-2-yl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide
CID 2406609
N-[2-(cyclohexen-1-yl)ethyl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide
CID 8703770
1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]ethanone
CID 7417896
N-(2-cyclopentylpyrazol-3-yl)-2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetamide
CID 9328321
N-(4-bromophenyl)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]acetamide
CID 2653629
N-[2-[(2R)-butan-2-yl]phenyl]-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]acetamide
CID 8687635

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide?
The IUPAC name of 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide (CID 7060420) is 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide.
What is the SMILES notation for 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide?
The canonical SMILES for 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide is CCOc1ccccc1N1CC[NH+](CC(=O)NN)CC1.
What is the InChIKey of 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide?
The InChIKey is WGPQKHCWNCNAFS-UHFFFAOYSA-O. The full InChI is InChI=1S/C14H22N4O2/c1-2-20-13-6-4-3-5-12(13)18-9-7-17(8-10-18)11-14(19)16-15/h3-6H,2,7-11,15H2,1H3,(H,16,19)/p+1.
What are the key properties of 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide?
2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide has a molecular weight of 279.36 g/mol, XLogP of -1.22, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-ethoxyphenyl)piperazin-1-ium-1-yl]acetohydrazide is sourced from PubChem (CID 7060420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).