2-(6-formylindol-1-yl)acetamide

C11H10N2O2 — CID 28958282

IUPAC2-(6-formylindol-1-yl)acetamide
SMILESNC(=O)Cn1ccc2ccc(C=O)cc21
InChIInChI=1S/C11H10N2O2/c12-11(15)6-13-4-3-9-2-1-8(7-14)5-10(9)13/h1-5,7H,6H2,(H2,12,15)
InChIKeyAAIHEZLKQACFTB-UHFFFAOYSA-N
MW202.21 g/mol
LogP0.94
Rot. Bonds3

About 2-(6-formylindol-1-yl)acetamide

2-(6-formylindol-1-yl)acetamide (PubChem CID 28958282) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is 2-(6-formylindol-1-yl)acetamide.

Molecular Properties

Compound Name2-(6-formylindol-1-yl)acetamide
PubChem CID28958282
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name2-(6-formylindol-1-yl)acetamide
SMILESNC(=O)Cn1ccc2ccc(C=O)cc21
InChIInChI=1S/C11H10N2O2/c12-11(15)6-13-4-3-9-2-1-8(7-14)5-10(9)13/h1-5,7H,6H2,(H2,12,15)
InChIKeyAAIHEZLKQACFTB-UHFFFAOYSA-N
XLogP0.94
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(6-formylindol-1-yl)acetamide?
The IUPAC name of 2-(6-formylindol-1-yl)acetamide (CID 28958282) is 2-(6-formylindol-1-yl)acetamide.
What is the SMILES notation for 2-(6-formylindol-1-yl)acetamide?
The canonical SMILES for 2-(6-formylindol-1-yl)acetamide is NC(=O)Cn1ccc2ccc(C=O)cc21.
What is the InChIKey of 2-(6-formylindol-1-yl)acetamide?
The InChIKey is AAIHEZLKQACFTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O2/c12-11(15)6-13-4-3-9-2-1-8(7-14)5-10(9)13/h1-5,7H,6H2,(H2,12,15).
What are the key properties of 2-(6-formylindol-1-yl)acetamide?
2-(6-formylindol-1-yl)acetamide has a molecular weight of 202.21 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-formylindol-1-yl)acetamide is sourced from PubChem (CID 28958282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).