N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide

C17H16N2O2 — CID 562745

IUPACN-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide
SMILESCC(=O)NC1C(=O)N(Cc2ccccc2)c2ccccc21
InChIInChI=1S/C17H16N2O2/c1-12(20)18-16-14-9-5-6-10-15(14)19(17(16)21)11-13-7-3-2-4-8-13/h2-10,16H,11H2,1H3,(H,18,20)
InChIKeyZXEUGBUFRQITPK-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.41
Rot. Bonds3

About N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide

N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide (PubChem CID 562745) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide
PubChem CID562745
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC NameN-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide
SMILESCC(=O)NC1C(=O)N(Cc2ccccc2)c2ccccc21
InChIInChI=1S/C17H16N2O2/c1-12(20)18-16-14-9-5-6-10-15(14)19(17(16)21)11-13-7-3-2-4-8-13/h2-10,16H,11H2,1H3,(H,18,20)
InChIKeyZXEUGBUFRQITPK-UHFFFAOYSA-N
XLogP2.41
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide?
The IUPAC name of N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide (CID 562745) is N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide.
What is the SMILES notation for N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide?
The canonical SMILES for N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide is CC(=O)NC1C(=O)N(Cc2ccccc2)c2ccccc21.
What is the InChIKey of N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide?
The InChIKey is ZXEUGBUFRQITPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c1-12(20)18-16-14-9-5-6-10-15(14)19(17(16)21)11-13-7-3-2-4-8-13/h2-10,16H,11H2,1H3,(H,18,20).
What are the key properties of N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide?
N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide has a molecular weight of 280.33 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzyl-2-oxo-3H-indol-3-yl)acetamide is sourced from PubChem (CID 562745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).