4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide

C24H24N2O4 — CID 55415145

IUPAC4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide
SMILESCOc1cc(C(=O)NCC(c2ccccc2)c2ccccc2)ccc1OCC(N)=O
InChIInChI=1S/C24H24N2O4/c1-29-22-14-19(12-13-21(22)30-16-23(25)27)24(28)26-15-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,20H,15-16H2,1H3,(H2,25,27)(H,26,28)
InChIKeyHTKNBYVYPDXJHG-UHFFFAOYSA-N
MW404.47 g/mol
LogP3.12
Rot. Bonds9

About 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide

4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide (PubChem CID 55415145) has the molecular formula C24H24N2O4 and a molecular weight of 404.47 g/mol. Its IUPAC name is 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide.

Molecular Properties

Compound Name4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide
PubChem CID55415145
Molecular FormulaC24H24N2O4
Molecular Weight404.47 g/mol
Exact Mass404.17
IUPAC Name4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide
SMILESCOc1cc(C(=O)NCC(c2ccccc2)c2ccccc2)ccc1OCC(N)=O
InChIInChI=1S/C24H24N2O4/c1-29-22-14-19(12-13-21(22)30-16-23(25)27)24(28)26-15-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,20H,15-16H2,1H3,(H2,25,27)(H,26,28)
InChIKeyHTKNBYVYPDXJHG-UHFFFAOYSA-N
XLogP3.12
TPSA90.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.47
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-amino-2-oxoethoxy)-3-methoxy-N-(2-phenylsulfanylethyl)benzamide
CID 8529507
4-(2-amino-2-oxoethoxy)-N-(2-amino-2-phenylethyl)-3,5-dimethoxybenzamide
CID 119527473
4-(2-amino-2-oxoethoxy)-N-[(4-chlorophenyl)-phenylmethyl]-3-methoxybenzamide
CID 55414528
methyl 2-[2-methoxy-4-(2-phenylbutylcarbamoyl)phenoxy]acetate
CID 55773551
4-(2-amino-2-oxoethoxy)-N-[(3,4-dimethoxyphenyl)methyl]-3-methoxybenzamide
CID 9082611
(2S)-2-[[4-(2-amino-2-oxoethoxy)-3-methoxybenzoyl]amino]propanoic acid
CID 119237902
4-(2-amino-2-oxoethoxy)-N-[2-(ethylamino)ethyl]-3-methoxybenzamide
CID 119505377
N-[2-(dimethylamino)-2-phenylethyl]-4-ethoxy-3-methoxybenzamide
CID 51166343
4-(2-amino-2-oxoethoxy)-N-[2-(ethylamino)ethyl]-3-methoxybenzamide;hydrochloride
CID 119505376
4-(2-amino-2-oxoethoxy)-3-methoxy-N-(2-methylphenyl)benzamide
CID 8872324
4-(2-amino-2-oxoethoxy)-3-methoxybenzamide
CID 47120011
4-butoxy-3-methoxy-N-[(2S)-2-phenylpropyl]benzamide
CID 9302117

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide?
The IUPAC name of 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide (CID 55415145) is 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide.
What is the SMILES notation for 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide?
The canonical SMILES for 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide is COc1cc(C(=O)NCC(c2ccccc2)c2ccccc2)ccc1OCC(N)=O.
What is the InChIKey of 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide?
The InChIKey is HTKNBYVYPDXJHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O4/c1-29-22-14-19(12-13-21(22)30-16-23(25)27)24(28)26-15-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14,20H,15-16H2,1H3,(H2,25,27)(H,26,28).
What are the key properties of 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide?
4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide has a molecular weight of 404.47 g/mol, XLogP of 3.12, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-oxoethoxy)-N-(2,2-diphenylethyl)-3-methoxybenzamide is sourced from PubChem (CID 55415145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).