N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide

C19H20N2O2 — CID 42424076

IUPACN-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide
SMILESCC(=O)N1CCc2cc(NC(=O)c3ccc(C)cc3C)ccc21
InChIInChI=1S/C19H20N2O2/c1-12-4-6-17(13(2)10-12)19(23)20-16-5-7-18-15(11-16)8-9-21(18)14(3)22/h4-7,10-11H,8-9H2,1-3H3,(H,20,23)
InChIKeyKZQQEMHIAMJUAH-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.46
Rot. Bonds2

About N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide

N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide (PubChem CID 42424076) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide
PubChem CID42424076
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide
SMILESCC(=O)N1CCc2cc(NC(=O)c3ccc(C)cc3C)ccc21
InChIInChI=1S/C19H20N2O2/c1-12-4-6-17(13(2)10-12)19(23)20-16-5-7-18-15(11-16)8-9-21(18)14(3)22/h4-7,10-11H,8-9H2,1-3H3,(H,20,23)
InChIKeyKZQQEMHIAMJUAH-UHFFFAOYSA-N
XLogP3.46
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide
CID 35805071
1-(1-acetyl-2,3-dihydroindol-5-yl)-3-(4-methylphenyl)urea
CID 17485020
methane;1-(5-methyl-2,3-dihydroindol-1-yl)ethanone
CID 159834618
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-methyl-3-nitrobenzamide
CID 42423999
N-(1-acetyl-2,3-dihydroindol-5-yl)-3-methyl-1,2-oxazole-5-carboxamide
CID 51205594
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-bromoacetamide
CID 63679851
N-(1-acetyl-2,3-dihydroindol-5-yl)-4-(methylsulfamoyl)benzamide
CID 51219427
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 30494390
N-(1-acetyl-2,3-dihydroindol-6-yl)-2-methyl-4-(3,3,3-trifluoroprop-1-enyl)benzamide
CID 68701762
N-(1-acetyl-2,3-dihydroindol-5-yl)-5-chloro-1,3-dimethylpyrazole-4-carboxamide
CID 18205048
methyl 5-[(1-acetyl-2,3-dihydroindol-5-yl)carbamoyl]thiophene-2-carboxylate
CID 35187739
N-(1-acetyl-2,3-dihydroindol-5-yl)-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 39952143

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide?
The IUPAC name of N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide (CID 42424076) is N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide.
What is the SMILES notation for N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide?
The canonical SMILES for N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide is CC(=O)N1CCc2cc(NC(=O)c3ccc(C)cc3C)ccc21.
What is the InChIKey of N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide?
The InChIKey is KZQQEMHIAMJUAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-12-4-6-17(13(2)10-12)19(23)20-16-5-7-18-15(11-16)8-9-21(18)14(3)22/h4-7,10-11H,8-9H2,1-3H3,(H,20,23).
What are the key properties of N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide?
N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide has a molecular weight of 308.38 g/mol, XLogP of 3.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide is sourced from PubChem (CID 42424076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).