N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide

C20H22N2O3 — CID 27669306

IUPACN-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide
SMILESCN(C)C(=O)COc1ccccc1C(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C20H22N2O3/c1-22(2)19(23)13-25-18-9-4-3-8-17(18)20(24)21-16-11-10-14-6-5-7-15(14)12-16/h3-4,8-12H,5-7,13H2,1-2H3,(H,21,24)
InChIKeyVURGTOAGJPQKCD-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.89
Rot. Bonds5

About N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide

N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide (PubChem CID 27669306) has the molecular formula C20H22N2O3 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide
PubChem CID27669306
Molecular FormulaC20H22N2O3
Molecular Weight338.41 g/mol
Exact Mass338.16
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide
SMILESCN(C)C(=O)COc1ccccc1C(=O)Nc1ccc2c(c1)CCC2
InChIInChI=1S/C20H22N2O3/c1-22(2)19(23)13-25-18-9-4-3-8-17(18)20(24)21-16-11-10-14-6-5-7-15(14)12-16/h3-4,8-12H,5-7,13H2,1-2H3,(H,21,24)
InChIKeyVURGTOAGJPQKCD-UHFFFAOYSA-N
XLogP2.89
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(dimethylamino)-2-oxoethoxy]-N-(4-methoxyphenyl)benzamide
CID 34815754
2-[2-(dimethylamino)-2-oxoethoxy]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 27666765
2-[2-(dimethylamino)-2-oxoethoxy]-N-(4-ethyl-3-nitrophenyl)benzamide
CID 30870966
2-[2-(dimethylamino)-2-oxoethoxy]-N-[4-methoxy-3-(4-methoxyphenoxy)phenyl]benzamide
CID 30257849
N-(2,3-dihydro-1H-inden-5-yl)-2,3-dimethoxybenzamide
CID 26198866
N-(2,3-dihydro-1H-inden-5-yl)-2-(2-hydroxyphenoxy)acetamide
CID 78780058
2-bromo-N-(2,3-dihydro-1H-inden-5-yl)benzamide
CID 2673412
N-(4,5-dihydro-1,3-thiazol-2-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide
CID 51073257
2-ethoxy-N-(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide
CID 16930837
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
N-(2,3-dihydro-1H-inden-5-yl)-2-(2-formylphenoxy)acetamide
CID 7762710
2-methoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide
CID 18687364

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide (CID 27669306) is N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide is CN(C)C(=O)COc1ccccc1C(=O)Nc1ccc2c(c1)CCC2.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide?
The InChIKey is VURGTOAGJPQKCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O3/c1-22(2)19(23)13-25-18-9-4-3-8-17(18)20(24)21-16-11-10-14-6-5-7-15(14)12-16/h3-4,8-12H,5-7,13H2,1-2H3,(H,21,24).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide?
N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide has a molecular weight of 338.41 g/mol, XLogP of 2.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-2-[2-(dimethylamino)-2-oxoethoxy]benzamide is sourced from PubChem (CID 27669306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).