N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide

C19H18N2O3 — CID 110746143

IUPACN-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide
SMILESCC(=O)c1ccc2c(c1)CCN2C(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C19H18N2O3/c1-13(22)15-7-8-17-16(11-15)9-10-21(17)18(23)12-20-19(24)14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,20,24)
InChIKeyUIWJQYPIUJCLRE-UHFFFAOYSA-N
MW322.36 g/mol
LogP2.21
Rot. Bonds4

About N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide

N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide (PubChem CID 110746143) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide
PubChem CID110746143
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide
SMILESCC(=O)c1ccc2c(c1)CCN2C(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C19H18N2O3/c1-13(22)15-7-8-17-16(11-15)9-10-21(17)18(23)12-20-19(24)14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,20,24)
InChIKeyUIWJQYPIUJCLRE-UHFFFAOYSA-N
XLogP2.21
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide?
The IUPAC name of N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide (CID 110746143) is N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide is CC(=O)c1ccc2c(c1)CCN2C(=O)CNC(=O)c1ccccc1.
What is the InChIKey of N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide?
The InChIKey is UIWJQYPIUJCLRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-13(22)15-7-8-17-16(11-15)9-10-21(17)18(23)12-20-19(24)14-5-3-2-4-6-14/h2-8,11H,9-10,12H2,1H3,(H,20,24).
What are the key properties of N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide?
N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide has a molecular weight of 322.36 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-acetyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide is sourced from PubChem (CID 110746143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).