N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide

C21H28N2O — CID 112504225

IUPACN-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide
SMILESCCN(CC)C(CNC(=O)Cc1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C21H28N2O/c1-4-23(5-2)20(19-13-11-17(3)12-14-19)16-22-21(24)15-18-9-7-6-8-10-18/h6-14,20H,4-5,15-16H2,1-3H3,(H,22,24)
InChIKeyINQYJPJZPYUFBI-UHFFFAOYSA-N
MW324.47 g/mol
LogP3.74
Rot. Bonds8

About N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide

N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide (PubChem CID 112504225) has the molecular formula C21H28N2O and a molecular weight of 324.47 g/mol. Its IUPAC name is N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide
PubChem CID112504225
Molecular FormulaC21H28N2O
Molecular Weight324.47 g/mol
Exact Mass324.22
IUPAC NameN-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide
SMILESCCN(CC)C(CNC(=O)Cc1ccccc1)c1ccc(C)cc1
InChIInChI=1S/C21H28N2O/c1-4-23(5-2)20(19-13-11-17(3)12-14-19)16-22-21(24)15-18-9-7-6-8-10-18/h6-14,20H,4-5,15-16H2,1-3H3,(H,22,24)
InChIKeyINQYJPJZPYUFBI-UHFFFAOYSA-N
XLogP3.74
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.47
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2S)-2-(diethylamino)-2-phenylethyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 8798590
N-[2-(diethylamino)-2-phenylethyl]-3-sulfanylpropanamide
CID 107020132
N-[(2S)-2-(dimethylamino)-2-phenylethyl]-2-(3-methylphenyl)acetamide
CID 41453338
2-[[2-(diethylamino)-2-phenylethyl]amino]-2-oxoacetic acid
CID 43444924
N-[2-(diethylamino)-2-phenylethyl]-3-hydroxy-4-methylpentanamide
CID 75386938
N-[2-(diethylamino)-2-phenylethyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylbenzamide
CID 112764996
N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]-2-phenylacetamide
CID 43843128
2-benzyl-3-[[2-(4-methylphenyl)acetyl]amino]propanoic acid
CID 119234039
N-[2-(diethylamino)-2-phenylethyl]-2-(2-methylphenoxy)acetamide
CID 18167114
N-[(2R)-2-(4-methylphenyl)-2-piperidin-1-ylethyl]-2-phenylacetamide
CID 34952082
N-[2-[[2-(diethylamino)-2-phenylethyl]amino]-2-oxoethyl]-3,4-dimethylbenzamide
CID 18167164
3-[2-(diethylamino)-2-phenylethyl]-1-ethyl-1-methylurea
CID 115603913

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide?
The IUPAC name of N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide (CID 112504225) is N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide is CCN(CC)C(CNC(=O)Cc1ccccc1)c1ccc(C)cc1.
What is the InChIKey of N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide?
The InChIKey is INQYJPJZPYUFBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O/c1-4-23(5-2)20(19-13-11-17(3)12-14-19)16-22-21(24)15-18-9-7-6-8-10-18/h6-14,20H,4-5,15-16H2,1-3H3,(H,22,24).
What are the key properties of N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide?
N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide has a molecular weight of 324.47 g/mol, XLogP of 3.74, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)-2-(4-methylphenyl)ethyl]-2-phenylacetamide is sourced from PubChem (CID 112504225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).