N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide

C15H22N2O2 — CID 94274700

IUPACN-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(C(=O)C(=O)NCCN(C)C)cc1
InChIInChI=1S/C15H22N2O2/c1-11(2)12-5-7-13(8-6-12)14(18)15(19)16-9-10-17(3)4/h5-8,11H,9-10H2,1-4H3,(H,16,19)
InChIKeyYPKVBPKVLJCOET-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.67
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide

N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide (PubChem CID 94274700) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide
PubChem CID94274700
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccc(C(=O)C(=O)NCCN(C)C)cc1
InChIInChI=1S/C15H22N2O2/c1-11(2)12-5-7-13(8-6-12)14(18)15(19)16-9-10-17(3)4/h5-8,11H,9-10H2,1-4H3,(H,16,19)
InChIKeyYPKVBPKVLJCOET-UHFFFAOYSA-N
XLogP1.67
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methoxyethyl)-2-oxo-2-(4-propan-2-ylphenyl)acetamide
CID 94268074
1-[2-(dimethylamino)ethyl]-3-(4-propan-2-ylphenyl)thiourea
CID 8624818
2-[3-(dimethylamino)propylamino]-1-(4-propan-2-ylphenyl)ethanone
CID 82101362
3-N-[2-(dimethylamino)ethyl]-5-N-(4-propan-2-ylphenyl)pyridine-3,5-dicarboxamide
CID 109104104
N-[2-(dimethylamino)ethyl]-2-(2,4-dimethylphenyl)-2-oxoacetamide
CID 94267774
N-[2-(dimethylamino)ethyl]-N'-[(1R)-1-phenylethyl]oxamide
CID 2207238
2-[2-(dimethylamino)ethylamino]-N-(4-propan-2-ylphenyl)acetamide
CID 108994500
3-(4-aminophenyl)-N-[2-(dimethylamino)ethyl]butanamide
CID 113420011
2-methyl-1-(4-propan-2-ylphenyl)but-2-en-1-one
CID 123351544
N-(2-hydroxypropylcarbamothioyl)-4-propan-2-ylbenzamide
CID 17177805
3-bromo-1-(4-propan-2-ylphenyl)propane-1,2-dione
CID 82134238
N-[2-(dimethylamino)ethyl]-4-propan-2-ylsulfonylbenzamide
CID 110764850

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide (CID 94274700) is N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide is CC(C)c1ccc(C(=O)C(=O)NCCN(C)C)cc1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide?
The InChIKey is YPKVBPKVLJCOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(2)12-5-7-13(8-6-12)14(18)15(19)16-9-10-17(3)4/h5-8,11H,9-10H2,1-4H3,(H,16,19).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide?
N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide has a molecular weight of 262.35 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-oxo-2-(4-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 94274700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).