N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide

C15H23N3O — CID 43266229

IUPACN-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
SMILESCCC1CCCCN1CC(=O)Nc1cccc(N)c1
InChIInChI=1S/C15H23N3O/c1-2-14-8-3-4-9-18(14)11-15(19)17-13-7-5-6-12(16)10-13/h5-7,10,14H,2-4,8-9,11,16H2,1H3,(H,17,19)
InChIKeyHCRLVLOPTUTOFX-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.47
Rot. Bonds4

About N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide

N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide (PubChem CID 43266229) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
PubChem CID43266229
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC NameN-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
SMILESCCC1CCCCN1CC(=O)Nc1cccc(N)c1
InChIInChI=1S/C15H23N3O/c1-2-14-8-3-4-9-18(14)11-15(19)17-13-7-5-6-12(16)10-13/h5-7,10,14H,2-4,8-9,11,16H2,1H3,(H,17,19)
InChIKeyHCRLVLOPTUTOFX-UHFFFAOYSA-N
XLogP2.47
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

Analyze N-(3-aminophenyl)-2-(2-ethylpiperidin-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

2-[(2S)-2-ethylpiperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 129380241
2-(2-ethylpiperidin-1-yl)-N-(3-iodophenyl)acetamide
CID 47104594
N-(3-aminophenyl)-2-[2-(hydroxymethyl)pyrrolidin-1-yl]acetamide
CID 61407514
2-(2-ethylpiperidin-1-yl)-N-(3-nitrophenyl)acetamide
CID 171704776
N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide
CID 43266257
N-(3,4-difluorophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 42999278
N-(4-amino-2-methylphenyl)-2-(2-ethylazepan-1-yl)acetamide
CID 104689012
N-(3-aminophenyl)-3-(2-propylpiperidin-1-yl)propanamide
CID 83052120
2-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-N-(3-aminophenyl)acetamide
CID 82746898
N-(4-acetylphenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 109006395
N-(3-acetamidophenyl)-3-(2-ethylpiperidin-1-yl)propanamide
CID 109032765
N-(4-amino-2-methylphenyl)-2-(2-ethylpyrrolidin-1-yl)acetamide
CID 54882930

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide?
The IUPAC name of N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide (CID 43266229) is N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide?
The canonical SMILES for N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide is CCC1CCCCN1CC(=O)Nc1cccc(N)c1.
What is the InChIKey of N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide?
The InChIKey is HCRLVLOPTUTOFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-2-14-8-3-4-9-18(14)11-15(19)17-13-7-5-6-12(16)10-13/h5-7,10,14H,2-4,8-9,11,16H2,1H3,(H,17,19).
What are the key properties of N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide?
N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide has a molecular weight of 261.37 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide is sourced from PubChem (CID 43266229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).