2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide

C11H14N2O2 — CID 71174662

IUPAC2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide
SMILESCOc1ccc2c(c1)C(CC(N)=O)CN2
InChIInChI=1S/C11H14N2O2/c1-15-8-2-3-10-9(5-8)7(6-13-10)4-11(12)14/h2-3,5,7,13H,4,6H2,1H3,(H2,12,14)
InChIKeyZQVHBDLMDAQSQB-UHFFFAOYSA-N
MW206.24 g/mol
LogP1.08
Rot. Bonds3

About 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide

2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide (PubChem CID 71174662) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide.

Molecular Properties

Compound Name2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide
PubChem CID71174662
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide
SMILESCOc1ccc2c(c1)C(CC(N)=O)CN2
InChIInChI=1S/C11H14N2O2/c1-15-8-2-3-10-9(5-8)7(6-13-10)4-11(12)14/h2-3,5,7,13H,4,6H2,1H3,(H2,12,14)
InChIKeyZQVHBDLMDAQSQB-UHFFFAOYSA-N
XLogP1.08
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide?
The IUPAC name of 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide (CID 71174662) is 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide.
What is the SMILES notation for 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide?
The canonical SMILES for 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide is COc1ccc2c(c1)C(CC(N)=O)CN2.
What is the InChIKey of 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide?
The InChIKey is ZQVHBDLMDAQSQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-15-8-2-3-10-9(5-8)7(6-13-10)4-11(12)14/h2-3,5,7,13H,4,6H2,1H3,(H2,12,14).
What are the key properties of 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide?
2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide has a molecular weight of 206.24 g/mol, XLogP of 1.08, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methoxy-2,3-dihydro-1H-indol-3-yl)acetamide is sourced from PubChem (CID 71174662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).