4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide

C20H24N2O3 — CID 16545469

IUPAC4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide
SMILESCC(C)(C)N(Cc1ccccc1)C(=O)COc1ccc(C(N)=O)cc1
InChIInChI=1S/C20H24N2O3/c1-20(2,3)22(13-15-7-5-4-6-8-15)18(23)14-25-17-11-9-16(10-12-17)19(21)24/h4-12H,13-14H2,1-3H3,(H2,21,24)
InChIKeyIHFKKFFDAVTGRJ-UHFFFAOYSA-N
MW340.42 g/mol
LogP2.99
Rot. Bonds6

About 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide

4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide (PubChem CID 16545469) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide
PubChem CID16545469
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide
SMILESCC(C)(C)N(Cc1ccccc1)C(=O)COc1ccc(C(N)=O)cc1
InChIInChI=1S/C20H24N2O3/c1-20(2,3)22(13-15-7-5-4-6-8-15)18(23)14-25-17-11-9-16(10-12-17)19(21)24/h4-12H,13-14H2,1-3H3,(H2,21,24)
InChIKeyIHFKKFFDAVTGRJ-UHFFFAOYSA-N
XLogP2.99
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-N-tert-butyl-2-phenoxyacetamide
CID 2927672
2-(4-acetamidophenoxy)-N-benzyl-N-tert-butylacetamide
CID 7640062
N-benzyl-N-tert-butyl-2-(2,4-dimethylphenoxy)acetamide
CID 891434
4-[2-[bis[(2S)-butan-2-yl]amino]-2-oxoethoxy]benzamide
CID 8566212
[2-[benzyl(tert-butyl)amino]-2-oxoethyl] 3-hydroxy-4-methylbenzoate
CID 46660738
N-benzyl-N-tert-butyl-2-(2,4-dichlorophenoxy)acetamide
CID 3303263
benzamide;1,4-diethoxybenzene
CID 162120306
[2-[benzyl(tert-butyl)amino]-2-oxoethyl] 2-(2-phenylphenoxy)acetate
CID 16532999
4-[2-(benzylamino)-2-oxoethoxy]benzamide
CID 7931534
[2-[benzyl(methyl)amino]-2-oxoethyl] 4-(2-amino-2-oxoethoxy)benzoate
CID 8678279
4-[3-[benzyl(methyl)amino]-2-hydroxypropoxy]benzamide
CID 109415224
[2-[benzyl(tert-butyl)amino]-2-oxoethyl] 3,5-dinitrobenzoate
CID 53317265

Frequently Asked Questions

What is the IUPAC name of 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide?
The IUPAC name of 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide (CID 16545469) is 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide.
What is the SMILES notation for 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide?
The canonical SMILES for 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide is CC(C)(C)N(Cc1ccccc1)C(=O)COc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide?
The InChIKey is IHFKKFFDAVTGRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-20(2,3)22(13-15-7-5-4-6-8-15)18(23)14-25-17-11-9-16(10-12-17)19(21)24/h4-12H,13-14H2,1-3H3,(H2,21,24).
What are the key properties of 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide?
4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide has a molecular weight of 340.42 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[benzyl(tert-butyl)amino]-2-oxoethoxy]benzamide is sourced from PubChem (CID 16545469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).