N-cyclohexyl-N-ethyl-2,2-diphenylacetamide

C22H27NO — CID 21210383

IUPACN-cyclohexyl-N-ethyl-2,2-diphenylacetamide
SMILESCCN(C(=O)C(c1ccccc1)c1ccccc1)C1CCCCC1
InChIInChI=1S/C22H27NO/c1-2-23(20-16-10-5-11-17-20)22(24)21(18-12-6-3-7-13-18)19-14-8-4-9-15-19/h3-4,6-9,12-15,20-21H,2,5,10-11,16-17H2,1H3
InChIKeyKJZBQUBNRLMSQJ-UHFFFAOYSA-N
MW321.46 g/mol
LogP5.00
Rot. Bonds5

About N-cyclohexyl-N-ethyl-2,2-diphenylacetamide

N-cyclohexyl-N-ethyl-2,2-diphenylacetamide (PubChem CID 21210383) has the molecular formula C22H27NO and a molecular weight of 321.46 g/mol. Its IUPAC name is N-cyclohexyl-N-ethyl-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-N-ethyl-2,2-diphenylacetamide
PubChem CID21210383
Molecular FormulaC22H27NO
Molecular Weight321.46 g/mol
Exact Mass321.21
IUPAC NameN-cyclohexyl-N-ethyl-2,2-diphenylacetamide
SMILESCCN(C(=O)C(c1ccccc1)c1ccccc1)C1CCCCC1
InChIInChI=1S/C22H27NO/c1-2-23(20-16-10-5-11-17-20)22(24)21(18-12-6-3-7-13-18)19-14-8-4-9-15-19/h3-4,6-9,12-15,20-21H,2,5,10-11,16-17H2,1H3
InChIKeyKJZBQUBNRLMSQJ-UHFFFAOYSA-N
XLogP5.00
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.46
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-cyclohexyl-N-ethyl-2,2-diphenylacetamide 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-cyclohexyl-N-ethyl-2,2-diphenylacetamide?
The IUPAC name of N-cyclohexyl-N-ethyl-2,2-diphenylacetamide (CID 21210383) is N-cyclohexyl-N-ethyl-2,2-diphenylacetamide.
What is the SMILES notation for N-cyclohexyl-N-ethyl-2,2-diphenylacetamide?
The canonical SMILES for N-cyclohexyl-N-ethyl-2,2-diphenylacetamide is CCN(C(=O)C(c1ccccc1)c1ccccc1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-ethyl-2,2-diphenylacetamide?
The InChIKey is KJZBQUBNRLMSQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27NO/c1-2-23(20-16-10-5-11-17-20)22(24)21(18-12-6-3-7-13-18)19-14-8-4-9-15-19/h3-4,6-9,12-15,20-21H,2,5,10-11,16-17H2,1H3.
What are the key properties of N-cyclohexyl-N-ethyl-2,2-diphenylacetamide?
N-cyclohexyl-N-ethyl-2,2-diphenylacetamide has a molecular weight of 321.46 g/mol, XLogP of 5.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethyl-2,2-diphenylacetamide is sourced from PubChem (CID 21210383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).