N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

C10H11NO3 — CID 565773

IUPACN-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)OCCO2
InChIInChI=1S/C10H11NO3/c1-7(12)11-8-2-3-9-10(6-8)14-5-4-13-9/h2-3,6H,4-5H2,1H3,(H,11,12)
InChIKeyWGRBXYNOOMXHSY-UHFFFAOYSA-N
MW193.20 g/mol
LogP1.42
Rot. Bonds1

About N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide

N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide (PubChem CID 565773) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide.

Molecular Properties

Compound NameN-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
PubChem CID565773
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC NameN-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)OCCO2
InChIInChI=1S/C10H11NO3/c1-7(12)11-8-2-3-9-10(6-8)14-5-4-13-9/h2-3,6H,4-5H2,1H3,(H,11,12)
InChIKeyWGRBXYNOOMXHSY-UHFFFAOYSA-N
XLogP1.42
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The IUPAC name of N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide (CID 565773) is N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide.
What is the SMILES notation for N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The canonical SMILES for N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide is CC(=O)Nc1ccc2c(c1)OCCO2.
What is the InChIKey of N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
The InChIKey is WGRBXYNOOMXHSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO3/c1-7(12)11-8-2-3-9-10(6-8)14-5-4-13-9/h2-3,6H,4-5H2,1H3,(H,11,12).
What are the key properties of N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide?
N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide has a molecular weight of 193.20 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1,4-benzodioxin-6-yl)acetamide is sourced from PubChem (CID 565773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).