2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide

C24H24N2O3 — CID 174959966

IUPAC2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide
SMILESCc1cc(C)cc(NC(=O)c2ccccc2OCC(=O)NCc2ccccc2)c1
InChIInChI=1S/C24H24N2O3/c1-17-12-18(2)14-20(13-17)26-24(28)21-10-6-7-11-22(21)29-16-23(27)25-15-19-8-4-3-5-9-19/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyUWNZINCWXZZTSB-UHFFFAOYSA-N
MW388.47 g/mol
LogP4.25
Rot. Bonds7

About 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide

2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide (PubChem CID 174959966) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide.

Molecular Properties

Compound Name2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide
PubChem CID174959966
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide
SMILESCc1cc(C)cc(NC(=O)c2ccccc2OCC(=O)NCc2ccccc2)c1
InChIInChI=1S/C24H24N2O3/c1-17-12-18(2)14-20(13-17)26-24(28)21-10-6-7-11-22(21)29-16-23(27)25-15-19-8-4-3-5-9-19/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28)
InChIKeyUWNZINCWXZZTSB-UHFFFAOYSA-N
XLogP4.25
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(3,5-dimethylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 7980967
2-[2-(tert-butylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide
CID 1313364
methyl 4-[[[2-[2-(phenylcarbamoyl)phenoxy]acetyl]amino]methyl]benzoate
CID 7919593
2-(2-anilino-2-oxoethoxy)-N-benzylbenzamide
CID 4800998
2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 2709122
N-benzyl-2-[2-[(4-fluorophenyl)methylamino]-2-oxoethoxy]benzamide
CID 7981561
2-[2-oxo-2-(2-phenylethylamino)ethoxy]-N-phenylbenzamide
CID 2535242
N-benzyl-N'-(3,5-dimethylphenyl)propanediamide
CID 50949014
N-(3,5-dimethylphenyl)-2-(2-methylpropoxy)benzamide
CID 4945346
N-benzyl-2-[2-(2-ethoxyanilino)-2-oxoethoxy]benzamide
CID 7981661
[2-(benzylamino)-2-oxoethyl] 2-[2-(4-bromoanilino)-2-oxoethoxy]benzoate
CID 42965792
2-[2-(benzylamino)-2-oxoethoxy]-5-chlorobenzoic acid
CID 45417869

Frequently Asked Questions

What is the IUPAC name of 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide?
The IUPAC name of 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide (CID 174959966) is 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide.
What is the SMILES notation for 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide?
The canonical SMILES for 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide is Cc1cc(C)cc(NC(=O)c2ccccc2OCC(=O)NCc2ccccc2)c1.
What is the InChIKey of 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide?
The InChIKey is UWNZINCWXZZTSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-17-12-18(2)14-20(13-17)26-24(28)21-10-6-7-11-22(21)29-16-23(27)25-15-19-8-4-3-5-9-19/h3-14H,15-16H2,1-2H3,(H,25,27)(H,26,28).
What are the key properties of 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide?
2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide has a molecular weight of 388.47 g/mol, XLogP of 4.25, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(benzylamino)-2-oxoethoxy]-N-(3,5-dimethylphenyl)benzamide is sourced from PubChem (CID 174959966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).