2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide

C15H20N2O2 — CID 55099876

IUPAC2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CN1CCCC(C=O)C1)c1ccccc1
InChIInChI=1S/C15H20N2O2/c1-16(14-7-3-2-4-8-14)15(19)11-17-9-5-6-13(10-17)12-18/h2-4,7-8,12-13H,5-6,9-11H2,1H3
InChIKeyAUSWRYYTIAAQKV-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.56
Rot. Bonds4

About 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide

2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide (PubChem CID 55099876) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide.

Molecular Properties

Compound Name2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide
PubChem CID55099876
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide
SMILESCN(C(=O)CN1CCCC(C=O)C1)c1ccccc1
InChIInChI=1S/C15H20N2O2/c1-16(14-7-3-2-4-8-14)15(19)11-17-9-5-6-13(10-17)12-18/h2-4,7-8,12-13H,5-6,9-11H2,1H3
InChIKeyAUSWRYYTIAAQKV-UHFFFAOYSA-N
XLogP1.56
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide 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-(4-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide
CID 62656804
N-methyl-2-[3-(phenoxymethyl)piperidin-1-yl]-N-phenylacetamide
CID 86972191
N-[(2-fluorophenyl)methyl]-2-(3-formylpiperidin-1-yl)-N-methylacetamide
CID 62654574
N-ethyl-2-(3-formylpiperidin-1-yl)-N-methylacetamide
CID 62655686
2-(3-formylpiperidin-1-yl)-N-(2-methylsulfanylphenyl)acetamide
CID 62660823
(3R)-1-benzylpiperidine-3-carbaldehyde
CID 86316318
N-(4-aminophenyl)-2-[3-(methoxymethyl)piperidin-1-yl]-N-methylacetamide
CID 106585961
2-[3-[(3S)-1-[2-(N-methylanilino)-2-oxoethyl]piperidin-3-yl]pyrazol-1-yl]acetic acid
CID 126431666
3-methyl-1-[2-(N-methylanilino)-2-oxoethyl]piperidine-2-carboxylic acid
CID 107072416
2-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-N-methyl-N-phenylacetamide;hydrochloride
CID 119927602
2-(3-formylpiperidin-1-yl)-N-(3-phenylpropyl)acetamide
CID 62660631
3-(3-formylpiperidin-1-yl)-N,N-dimethylpropanamide
CID 62654927

Frequently Asked Questions

What is the IUPAC name of 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide?
The IUPAC name of 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide (CID 55099876) is 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide.
What is the SMILES notation for 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide?
The canonical SMILES for 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide is CN(C(=O)CN1CCCC(C=O)C1)c1ccccc1.
What is the InChIKey of 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide?
The InChIKey is AUSWRYYTIAAQKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-16(14-7-3-2-4-8-14)15(19)11-17-9-5-6-13(10-17)12-18/h2-4,7-8,12-13H,5-6,9-11H2,1H3.
What are the key properties of 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide?
2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide has a molecular weight of 260.34 g/mol, XLogP of 1.56, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-formylpiperidin-1-yl)-N-methyl-N-phenylacetamide is sourced from PubChem (CID 55099876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).