2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide

C16H12N2O2 — CID 3149448

IUPAC2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide
SMILESO=C(Nc1ccccc1)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C16H12N2O2/c19-15(16(20)18-11-6-2-1-3-7-11)13-10-17-14-9-5-4-8-12(13)14/h1-10,17H,(H,18,20)
InChIKeyWMCHMBHWRLPJKP-UHFFFAOYSA-N
MW264.28 g/mol
LogP2.99
Rot. Bonds3

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

2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide (PubChem CID 3149448) has the molecular formula C16H12N2O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide
PubChem CID3149448
Molecular FormulaC16H12N2O2
Molecular Weight264.28 g/mol
Exact Mass264.09
IUPAC Name2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide
SMILESO=C(Nc1ccccc1)C(=O)c1c[nH]c2ccccc12
InChIInChI=1S/C16H12N2O2/c19-15(16(20)18-11-6-2-1-3-7-11)13-10-17-14-9-5-4-8-12(13)14/h1-10,17H,(H,18,20)
InChIKeyWMCHMBHWRLPJKP-UHFFFAOYSA-N
XLogP2.99
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide?
The IUPAC name of 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide (CID 3149448) is 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide is O=C(Nc1ccccc1)C(=O)c1c[nH]c2ccccc12.
What is the InChIKey of 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide?
The InChIKey is WMCHMBHWRLPJKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O2/c19-15(16(20)18-11-6-2-1-3-7-11)13-10-17-14-9-5-4-8-12(13)14/h1-10,17H,(H,18,20).
What are the key properties of 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide?
2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide has a molecular weight of 264.28 g/mol, XLogP of 2.99, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-2-oxo-N-phenylacetamide is sourced from PubChem (CID 3149448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).