N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide

C19H22N2O2 — CID 142743444

IUPACN-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide
SMILESCCOCCN1CCc2ccc(NC(=O)c3ccccc3)cc21
InChIInChI=1S/C19H22N2O2/c1-2-23-13-12-21-11-10-15-8-9-17(14-18(15)21)20-19(22)16-6-4-3-5-7-16/h3-9,14H,2,10-13H2,1H3,(H,20,22)
InChIKeyOWTBXMROTOLWDL-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.34
Rot. Bonds6

About N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide

N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide (PubChem CID 142743444) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide.

Molecular Properties

Compound NameN-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide
PubChem CID142743444
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide
SMILESCCOCCN1CCc2ccc(NC(=O)c3ccccc3)cc21
InChIInChI=1S/C19H22N2O2/c1-2-23-13-12-21-11-10-15-8-9-17(14-18(15)21)20-19(22)16-6-4-3-5-7-16/h3-9,14H,2,10-13H2,1H3,(H,20,22)
InChIKeyOWTBXMROTOLWDL-UHFFFAOYSA-N
XLogP3.34
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(1-ethyl-2,3-dihydroindol-6-yl)-1-methyl-2,3-dihydroindole-5-carboxamide
CID 154840394
1-(2-ethoxyethyl)-2,3-dihydroindol-6-amine
CID 43457237
1-[2-(2-methylpropoxy)ethyl]-2,3-dihydroindole-6-carboxylic acid
CID 106454812
1-(2-propan-2-yloxyethyl)-2,3-dihydroindole-6-carboxylic acid
CID 113382494
5-benzamido-2,3-dihydroindole-1-carboxylic acid
CID 23147979
N-(4-benzamidophenyl)-4-(2-ethoxyethoxy)benzamide
CID 17235471
N-[1-(2-methoxyethyl)-3,4-dihydro-2H-quinolin-7-yl]-4-(4-methylcyclohexa-1,5-dien-1-yl)benzamide
CID 142273863
N-(4-benzamidophenyl)-3-(2-ethoxyethoxy)benzamide
CID 17235482
1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-(3-methoxypropyl)urea
CID 46384438
methyl 3-[[4-(2,3-dihydroindol-1-ylmethyl)benzoyl]amino]benzoate
CID 92677668
4-(2,3-dihydroindol-1-ylmethyl)-N-(4-ethylphenyl)benzamide
CID 99953473
4-ethoxy-N-(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)benzamide
CID 22597840

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide?
The IUPAC name of N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide (CID 142743444) is N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide.
What is the SMILES notation for N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide?
The canonical SMILES for N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide is CCOCCN1CCc2ccc(NC(=O)c3ccccc3)cc21.
What is the InChIKey of N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide?
The InChIKey is OWTBXMROTOLWDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-2-23-13-12-21-11-10-15-8-9-17(14-18(15)21)20-19(22)16-6-4-3-5-7-16/h3-9,14H,2,10-13H2,1H3,(H,20,22).
What are the key properties of N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide?
N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide has a molecular weight of 310.40 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-ethoxyethyl)-2,3-dihydroindol-6-yl]benzamide is sourced from PubChem (CID 142743444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).