2-(1,3-dioxoinden-2-yl)acetamide

C11H9NO3 — CID 69094521

IUPAC2-(1,3-dioxoinden-2-yl)acetamide
SMILESNC(=O)CC1C(=O)c2ccccc2C1=O
InChIInChI=1S/C11H9NO3/c12-9(13)5-8-10(14)6-3-1-2-4-7(6)11(8)15/h1-4,8H,5H2,(H2,12,13)
InChIKeyRVXKPOJTXFOSGH-UHFFFAOYSA-N
MW203.20 g/mol
LogP0.56
Rot. Bonds2

About 2-(1,3-dioxoinden-2-yl)acetamide

2-(1,3-dioxoinden-2-yl)acetamide (PubChem CID 69094521) has the molecular formula C11H9NO3 and a molecular weight of 203.20 g/mol. Its IUPAC name is 2-(1,3-dioxoinden-2-yl)acetamide.

Molecular Properties

Compound Name2-(1,3-dioxoinden-2-yl)acetamide
PubChem CID69094521
Molecular FormulaC11H9NO3
Molecular Weight203.20 g/mol
Exact Mass203.06
IUPAC Name2-(1,3-dioxoinden-2-yl)acetamide
SMILESNC(=O)CC1C(=O)c2ccccc2C1=O
InChIInChI=1S/C11H9NO3/c12-9(13)5-8-10(14)6-3-1-2-4-7(6)11(8)15/h1-4,8H,5H2,(H2,12,13)
InChIKeyRVXKPOJTXFOSGH-UHFFFAOYSA-N
XLogP0.56
TPSA77.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.20
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'keto_keto_beta_A(68)', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxoinden-2-yl)acetamide?
The IUPAC name of 2-(1,3-dioxoinden-2-yl)acetamide (CID 69094521) is 2-(1,3-dioxoinden-2-yl)acetamide.
What is the SMILES notation for 2-(1,3-dioxoinden-2-yl)acetamide?
The canonical SMILES for 2-(1,3-dioxoinden-2-yl)acetamide is NC(=O)CC1C(=O)c2ccccc2C1=O.
What is the InChIKey of 2-(1,3-dioxoinden-2-yl)acetamide?
The InChIKey is RVXKPOJTXFOSGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9NO3/c12-9(13)5-8-10(14)6-3-1-2-4-7(6)11(8)15/h1-4,8H,5H2,(H2,12,13).
What are the key properties of 2-(1,3-dioxoinden-2-yl)acetamide?
2-(1,3-dioxoinden-2-yl)acetamide has a molecular weight of 203.20 g/mol, XLogP of 0.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxoinden-2-yl)acetamide is sourced from PubChem (CID 69094521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).