N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide

C17H27N3O — CID 62691049

IUPACN-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide
SMILESCN(CCCNC(=O)CC1CCCNC1)c1ccccc1
InChIInChI=1S/C17H27N3O/c1-20(16-8-3-2-4-9-16)12-6-11-19-17(21)13-15-7-5-10-18-14-15/h2-4,8-9,15,18H,5-7,10-14H2,1H3,(H,19,21)
InChIKeyGGPLYCDEIWTSFK-UHFFFAOYSA-N
MW289.42 g/mol
LogP2.02
Rot. Bonds7

About N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide

N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide (PubChem CID 62691049) has the molecular formula C17H27N3O and a molecular weight of 289.42 g/mol. Its IUPAC name is N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide.

Molecular Properties

Compound NameN-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide
PubChem CID62691049
Molecular FormulaC17H27N3O
Molecular Weight289.42 g/mol
Exact Mass289.22
IUPAC NameN-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide
SMILESCN(CCCNC(=O)CC1CCCNC1)c1ccccc1
InChIInChI=1S/C17H27N3O/c1-20(16-8-3-2-4-9-16)12-6-11-19-17(21)13-15-7-5-10-18-14-15/h2-4,8-9,15,18H,5-7,10-14H2,1H3,(H,19,21)
InChIKeyGGPLYCDEIWTSFK-UHFFFAOYSA-N
XLogP2.02
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.42
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide 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-(N-methylanilino)ethyl]-2-piperidin-4-ylacetamide
CID 61260106
N-[3-(N-methylanilino)propyl]pyrrolidine-3-carboxamide
CID 63005380
N-(2-phenylethyl)-2-piperidin-3-ylacetamide
CID 62690707
N-[3-(N-methylanilino)propyl]-2-piperazin-1-ylacetamide
CID 29008728
N-(2-hydroxyethyl)-2-piperidin-3-ylacetamide
CID 22929447
2-(2,3-dihydro-1H-inden-1-yl)-N-[3-(N-methylanilino)propyl]acetamide
CID 86957177
N'-benzyl-N'-methyl-N-(piperidin-3-ylmethyl)propane-1,3-diamine
CID 80553136
N-[2-(N-methylanilino)ethyl]-2-morpholin-2-ylacetamide;dihydrochloride
CID 119837655
N-[3-(N-methylanilino)propyl]pentanamide
CID 78799629
N-butyl-2-[3-(N-methylanilino)propylamino]acetamide
CID 60693948
N-[2-(dimethylsulfamoyl)ethyl]-2-piperidin-3-ylacetamide
CID 106337529
N-[2-(3-methylphenyl)ethyl]-2-piperidin-3-ylacetamide
CID 62690046

Frequently Asked Questions

What is the IUPAC name of N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide?
The IUPAC name of N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide (CID 62691049) is N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide.
What is the SMILES notation for N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide?
The canonical SMILES for N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide is CN(CCCNC(=O)CC1CCCNC1)c1ccccc1.
What is the InChIKey of N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide?
The InChIKey is GGPLYCDEIWTSFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O/c1-20(16-8-3-2-4-9-16)12-6-11-19-17(21)13-15-7-5-10-18-14-15/h2-4,8-9,15,18H,5-7,10-14H2,1H3,(H,19,21).
What are the key properties of N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide?
N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide has a molecular weight of 289.42 g/mol, XLogP of 2.02, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(N-methylanilino)propyl]-2-piperidin-3-ylacetamide is sourced from PubChem (CID 62691049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).