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

C18H18N2O3 — CID 35805071

IUPACN-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide
SMILESCC(=O)N1CCc2cc(NC(=O)c3ccc(C)cc3O)ccc21
InChIInChI=1S/C18H18N2O3/c1-11-3-5-15(17(22)9-11)18(23)19-14-4-6-16-13(10-14)7-8-20(16)12(2)21/h3-6,9-10,22H,7-8H2,1-2H3,(H,19,23)
InChIKeyPWNDAVTXHJLSGU-UHFFFAOYSA-N
MW310.35 g/mol
LogP2.86
Rot. Bonds2

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

N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide (PubChem CID 35805071) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide.

Molecular Properties

Compound NameN-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide
PubChem CID35805071
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC NameN-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide
SMILESCC(=O)N1CCc2cc(NC(=O)c3ccc(C)cc3O)ccc21
InChIInChI=1S/C18H18N2O3/c1-11-3-5-15(17(22)9-11)18(23)19-14-4-6-16-13(10-14)7-8-20(16)12(2)21/h3-6,9-10,22H,7-8H2,1-2H3,(H,19,23)
InChIKeyPWNDAVTXHJLSGU-UHFFFAOYSA-N
XLogP2.86
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-acetyl-2,3-dihydroindol-5-yl)-2,4-dimethylbenzamide
CID 42424076
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)-2,4-difluoro-6-hydroxybenzamide
CID 71936135
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)-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
(2R)-N-(1-acetyl-2,3-dihydroindol-5-yl)-2-aminopropanamide;hydrochloride
CID 119271750
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-methyl-2-(methylamino)propanamide
CID 62836406

Frequently Asked Questions

What is the IUPAC name of N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide?
The IUPAC name of N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide (CID 35805071) is N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide.
What is the SMILES notation for N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide?
The canonical SMILES for N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide is CC(=O)N1CCc2cc(NC(=O)c3ccc(C)cc3O)ccc21.
What is the InChIKey of N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide?
The InChIKey is PWNDAVTXHJLSGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-11-3-5-15(17(22)9-11)18(23)19-14-4-6-16-13(10-14)7-8-20(16)12(2)21/h3-6,9-10,22H,7-8H2,1-2H3,(H,19,23).
What are the key properties of N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide?
N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide has a molecular weight of 310.35 g/mol, XLogP of 2.86, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-acetyl-2,3-dihydroindol-5-yl)-2-hydroxy-4-methylbenzamide is sourced from PubChem (CID 35805071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).