N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide

C22H26N2O — CID 22405818

IUPACN-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide
SMILESCN(CCN1CC2CC(c3ccccc3)C2C1)C(=O)c1ccccc1
InChIInChI=1S/C22H26N2O/c1-23(22(25)18-10-6-3-7-11-18)12-13-24-15-19-14-20(21(19)16-24)17-8-4-2-5-9-17/h2-11,19-21H,12-16H2,1H3
InChIKeyMPXQUETWNFHIRZ-UHFFFAOYSA-N
MW334.46 g/mol
LogP3.49
Rot. Bonds5

About N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide

N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide (PubChem CID 22405818) has the molecular formula C22H26N2O and a molecular weight of 334.46 g/mol. Its IUPAC name is N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide.

Molecular Properties

Compound NameN-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide
PubChem CID22405818
Molecular FormulaC22H26N2O
Molecular Weight334.46 g/mol
Exact Mass334.20
IUPAC NameN-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide
SMILESCN(CCN1CC2CC(c3ccccc3)C2C1)C(=O)c1ccccc1
InChIInChI=1S/C22H26N2O/c1-23(22(25)18-10-6-3-7-11-18)12-13-24-15-19-14-20(21(19)16-24)17-8-4-2-5-9-17/h2-11,19-21H,12-16H2,1H3
InChIKeyMPXQUETWNFHIRZ-UHFFFAOYSA-N
XLogP3.49
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 53.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide 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-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide?
The IUPAC name of N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide (CID 22405818) is N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide.
What is the SMILES notation for N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide?
The canonical SMILES for N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide is CN(CCN1CC2CC(c3ccccc3)C2C1)C(=O)c1ccccc1.
What is the InChIKey of N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide?
The InChIKey is MPXQUETWNFHIRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O/c1-23(22(25)18-10-6-3-7-11-18)12-13-24-15-19-14-20(21(19)16-24)17-8-4-2-5-9-17/h2-11,19-21H,12-16H2,1H3.
What are the key properties of N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide?
N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide has a molecular weight of 334.46 g/mol, XLogP of 3.49, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[2-(6-phenyl-3-azabicyclo[3.2.0]heptan-3-yl)ethyl]benzamide is sourced from PubChem (CID 22405818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).