N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide

C15H22N2O — CID 110856796

IUPACN-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
SMILESCc1ccc(NC(=O)CC2CCCCN2C)cc1
InChIInChI=1S/C15H22N2O/c1-12-6-8-13(9-7-12)16-15(18)11-14-5-3-4-10-17(14)2/h6-9,14H,3-5,10-11H2,1-2H3,(H,16,18)
InChIKeyJQRFQNUCVHZZFC-UHFFFAOYSA-N
MW246.35 g/mol
LogP2.81
Rot. Bonds3

About N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide

N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide (PubChem CID 110856796) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
PubChem CID110856796
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC NameN-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide
SMILESCc1ccc(NC(=O)CC2CCCCN2C)cc1
InChIInChI=1S/C15H22N2O/c1-12-6-8-13(9-7-12)16-15(18)11-14-5-3-4-10-17(14)2/h6-9,14H,3-5,10-11H2,1-2H3,(H,16,18)
InChIKeyJQRFQNUCVHZZFC-UHFFFAOYSA-N
XLogP2.81
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(4-methylphenyl)-2-(1-methylpiperidin-2-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

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide?
The IUPAC name of N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide (CID 110856796) is N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide.
What is the SMILES notation for N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide?
The canonical SMILES for N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide is Cc1ccc(NC(=O)CC2CCCCN2C)cc1.
What is the InChIKey of N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide?
The InChIKey is JQRFQNUCVHZZFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-12-6-8-13(9-7-12)16-15(18)11-14-5-3-4-10-17(14)2/h6-9,14H,3-5,10-11H2,1-2H3,(H,16,18).
What are the key properties of N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide?
N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide has a molecular weight of 246.35 g/mol, XLogP of 2.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-2-(1-methylpiperidin-2-yl)acetamide is sourced from PubChem (CID 110856796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).