N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide

C24H22N2O3 — CID 53093708

IUPACN-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCc1ccc2c(c1)CCN2C(=O)c1ccccc1
InChIInChI=1S/C24H22N2O3/c1-29-22-10-6-5-9-20(22)23(27)25-16-17-11-12-21-19(15-17)13-14-26(21)24(28)18-7-3-2-4-8-18/h2-12,15H,13-14,16H2,1H3,(H,25,27)
InChIKeyADXOXDGPENRRLO-UHFFFAOYSA-N
MW386.45 g/mol
LogP3.83
Rot. Bonds5

About N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide

N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide (PubChem CID 53093708) has the molecular formula C24H22N2O3 and a molecular weight of 386.45 g/mol. Its IUPAC name is N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide
PubChem CID53093708
Molecular FormulaC24H22N2O3
Molecular Weight386.45 g/mol
Exact Mass386.16
IUPAC NameN-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)NCc1ccc2c(c1)CCN2C(=O)c1ccccc1
InChIInChI=1S/C24H22N2O3/c1-29-22-10-6-5-9-20(22)23(27)25-16-17-11-12-21-19(15-17)13-14-26(21)24(28)18-7-3-2-4-8-18/h2-12,15H,13-14,16H2,1H3,(H,25,27)
InChIKeyADXOXDGPENRRLO-UHFFFAOYSA-N
XLogP3.83
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-(4-fluorobenzoyl)-2,3-dihydroindol-5-yl]methyl]-2-methoxybenzamide
CID 53093773
3-methoxy-N-[[1-(4-methylbenzoyl)-2,3-dihydroindol-5-yl]methyl]benzamide
CID 53093620
N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-3,4-diethoxybenzamide
CID 53093713
N-[[1-(4-fluorobenzoyl)-2,3-dihydroindol-5-yl]methyl]-3,4-dimethoxybenzamide
CID 53093752
methyl 2-(1-benzoyl-2,3-dihydroindol-5-yl)acetate
CID 10732628
N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-phenoxypropanamide
CID 53093735
N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-[(4-fluorophenyl)methylsulfanyl]acetamide
CID 53093738
(5-methoxy-2,3-dihydroindol-1-yl)-phenylmethanone
CID 86659859
3,4,5-trimethoxy-N-[(1-propanoyl-2,3-dihydroindol-5-yl)methyl]benzamide
CID 53043786
1-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-3-(furan-2-ylmethyl)urea
CID 53090079
N-[(3,4-dimethoxyphenyl)methyl]-1-(4-fluorobenzoyl)-2,3-dihydroindole-6-carboxamide
CID 53160371
N-(2,3-dihydro-1-benzofuran-5-ylmethyl)-2-methoxybenzamide
CID 110787049

Frequently Asked Questions

What is the IUPAC name of N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide?
The IUPAC name of N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide (CID 53093708) is N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide.
What is the SMILES notation for N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide?
The canonical SMILES for N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide is COc1ccccc1C(=O)NCc1ccc2c(c1)CCN2C(=O)c1ccccc1.
What is the InChIKey of N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide?
The InChIKey is ADXOXDGPENRRLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O3/c1-29-22-10-6-5-9-20(22)23(27)25-16-17-11-12-21-19(15-17)13-14-26(21)24(28)18-7-3-2-4-8-18/h2-12,15H,13-14,16H2,1H3,(H,25,27).
What are the key properties of N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide?
N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide has a molecular weight of 386.45 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-benzoyl-2,3-dihydroindol-5-yl)methyl]-2-methoxybenzamide is sourced from PubChem (CID 53093708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).