N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide

C18H20N2O — CID 51281191

IUPACN-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)NC2CCc3ccccc32)c1
InChIInChI=1S/C18H20N2O/c1-20(2)15-8-5-7-14(12-15)18(21)19-17-11-10-13-6-3-4-9-16(13)17/h3-9,12,17H,10-11H2,1-2H3,(H,19,21)
InChIKeyCKEDYRJEMZINOU-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.17
Rot. Bonds3

About N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide

N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide (PubChem CID 51281191) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide
PubChem CID51281191
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide
SMILESCN(C)c1cccc(C(=O)NC2CCc3ccccc32)c1
InChIInChI=1S/C18H20N2O/c1-20(2)15-8-5-7-14(12-15)18(21)19-17-11-10-13-6-3-4-9-16(13)17/h3-9,12,17H,10-11H2,1-2H3,(H,19,21)
InChIKeyCKEDYRJEMZINOU-UHFFFAOYSA-N
XLogP3.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(dimethylamino)-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 2441074
3-[methyl(methylsulfonyl)amino]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]benzamide
CID 95118644
4-(dimethylamino)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 4681400
[2-oxo-2-[[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl] 3-(dimethylamino)benzoate
CID 6599950
N-(2,3-dihydro-1H-inden-1-yl)-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 51297408
3-phenoxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 4842813
3-(diethylsulfamoyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 42964993
N-[(4S)-1-benzyl-4,5,6,7-tetrahydroindazol-4-yl]-3-(dimethylamino)benzamide
CID 51939181
4-cyano-N-(2,3-dihydro-1H-inden-1-yl)benzamide
CID 47126975
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]naphthalene-2-carboxamide
CID 7688440
N-(2,3-dihydro-1H-inden-1-yl)-4-(methylsulfamoyl)benzamide
CID 17444395
N-[(1R)-2,3-dihydro-1H-inden-1-yl]-2-hydroxybenzamide
CID 141027232

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide?
The IUPAC name of N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide (CID 51281191) is N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide?
The canonical SMILES for N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide is CN(C)c1cccc(C(=O)NC2CCc3ccccc32)c1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide?
The InChIKey is CKEDYRJEMZINOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-20(2)15-8-5-7-14(12-15)18(21)19-17-11-10-13-6-3-4-9-16(13)17/h3-9,12,17H,10-11H2,1-2H3,(H,19,21).
What are the key properties of N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide?
N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide has a molecular weight of 280.37 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-1-yl)-3-(dimethylamino)benzamide is sourced from PubChem (CID 51281191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).