N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide

C15H24N4O — CID 16783173

IUPACN-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide
SMILESCCN1CCN(CC(=O)Nc2ccccc2CN)CC1
InChIInChI=1S/C15H24N4O/c1-2-18-7-9-19(10-8-18)12-15(20)17-14-6-4-3-5-13(14)11-16/h3-6H,2,7-12,16H2,1H3,(H,17,20)
InChIKeySWQVCXFZKHCYIU-UHFFFAOYSA-N
MW276.38 g/mol
LogP0.72
Rot. Bonds5

About N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide

N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide (PubChem CID 16783173) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide
PubChem CID16783173
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide
SMILESCCN1CCN(CC(=O)Nc2ccccc2CN)CC1
InChIInChI=1S/C15H24N4O/c1-2-18-7-9-19(10-8-18)12-15(20)17-14-6-4-3-5-13(14)11-16/h3-6H,2,7-12,16H2,1H3,(H,17,20)
InChIKeySWQVCXFZKHCYIU-UHFFFAOYSA-N
XLogP0.72
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)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

N-[2-(aminomethyl)phenyl]-2-(4-methyl-1,4-diazepan-1-yl)acetamide
CID 28744880
N-[2-(aminomethyl)phenyl]-2-(4,4-dimethylazepan-1-yl)acetamide
CID 65283533
N-(2-ethoxyphenyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 6469217
2-[4-[2-(2-ethylanilino)-2-oxoethyl]piperazin-1-yl]-N-(2-methylphenyl)acetamide
CID 9436502
N-(2-ethylphenyl)-2-[4-[2-(2-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 9436558
N-[2-(aminomethyl)phenyl]-2-(3,5-dimethylpiperidin-1-yl)acetamide
CID 16787564
N-[2-(aminomethyl)phenyl]-2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]acetamide
CID 115965021
ethyl 2-[[2-(4-ethylpiperazin-1-yl)acetyl]amino]benzoate
CID 108995538
2-[4-[2-(diethylamino)-2-oxoethyl]piperazin-1-yl]-N-(2-ethylphenyl)acetamide
CID 30969143
2-(4-ethylpiperazin-1-yl)-N-(2-nitrophenyl)acetamide
CID 22199010
N-[2-(aminomethyl)phenyl]-2-[3-(methoxymethyl)pyrrolidin-1-yl]acetamide
CID 64571252
N-(3-chloro-2-methylphenyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 22199009

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide?
The IUPAC name of N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide (CID 16783173) is N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide.
What is the SMILES notation for N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide?
The canonical SMILES for N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide is CCN1CCN(CC(=O)Nc2ccccc2CN)CC1.
What is the InChIKey of N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide?
The InChIKey is SWQVCXFZKHCYIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-2-18-7-9-19(10-8-18)12-15(20)17-14-6-4-3-5-13(14)11-16/h3-6H,2,7-12,16H2,1H3,(H,17,20).
What are the key properties of N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide?
N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 0.72, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)phenyl]-2-(4-ethylpiperazin-1-yl)acetamide is sourced from PubChem (CID 16783173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).