N-dibenzo-p-dioxin-1-ylacetamide

C14H11NO3 — CID 13308325

IUPACN-dibenzo-p-dioxin-1-ylacetamide
SMILESCC(=O)Nc1cccc2c1Oc1ccccc1O2
InChIInChI=1S/C14H11NO3/c1-9(16)15-10-5-4-8-13-14(10)18-12-7-3-2-6-11(12)17-13/h2-8H,1H3,(H,15,16)
InChIKeyOURUXSCLQHMOLP-UHFFFAOYSA-N
MW241.25 g/mol
LogP3.54
Rot. Bonds1

About N-dibenzo-p-dioxin-1-ylacetamide

N-dibenzo-p-dioxin-1-ylacetamide (PubChem CID 13308325) has the molecular formula C14H11NO3 and a molecular weight of 241.25 g/mol. Its IUPAC name is N-dibenzo-p-dioxin-1-ylacetamide.

Molecular Properties

Compound NameN-dibenzo-p-dioxin-1-ylacetamide
PubChem CID13308325
Molecular FormulaC14H11NO3
Molecular Weight241.25 g/mol
Exact Mass241.07
IUPAC NameN-dibenzo-p-dioxin-1-ylacetamide
SMILESCC(=O)Nc1cccc2c1Oc1ccccc1O2
InChIInChI=1S/C14H11NO3/c1-9(16)15-10-5-4-8-13-14(10)18-12-7-3-2-6-11(12)17-13/h2-8H,1H3,(H,15,16)
InChIKeyOURUXSCLQHMOLP-UHFFFAOYSA-N
XLogP3.54
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3,4,5-tetrahydro-1,6-benzodioxocin-7-yl)acetamide
CID 15033690
N-[2-(methylamino)phenyl]acetamide
CID 22950987
2-dibenzo-p-dioxin-1-yl-2-oxoacetic acid
CID 22153878
2-(2-acetamidophenyl)-2-aminoacetic acid
CID 21317152
N-(1,3-dioxo-2-benzofuran-4-yl)acetamide;ethane
CID 143956506
N-(9,9'-spirobi[fluorene]-1-yl)acetamide
CID 175536540
N-[2-(2-acetamido-6-methylphenyl)-3-methylphenyl]acetamide
CID 22971546
N-(3-acetamido-2-formylphenyl)acetamide
CID 54088843
dibenzo-p-dioxin-1-sulfonic acid
CID 175796492
N-[2-(5-methylfuran-2-yl)phenyl]acetamide
CID 646782
N-(2-benzofuran-4-yl)acetamide
CID 174465432
N-(2-acetamidophenyl)propanamide
CID 885895

Frequently Asked Questions

What is the IUPAC name of N-dibenzo-p-dioxin-1-ylacetamide?
The IUPAC name of N-dibenzo-p-dioxin-1-ylacetamide (CID 13308325) is N-dibenzo-p-dioxin-1-ylacetamide.
What is the SMILES notation for N-dibenzo-p-dioxin-1-ylacetamide?
The canonical SMILES for N-dibenzo-p-dioxin-1-ylacetamide is CC(=O)Nc1cccc2c1Oc1ccccc1O2.
What is the InChIKey of N-dibenzo-p-dioxin-1-ylacetamide?
The InChIKey is OURUXSCLQHMOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO3/c1-9(16)15-10-5-4-8-13-14(10)18-12-7-3-2-6-11(12)17-13/h2-8H,1H3,(H,15,16).
What are the key properties of N-dibenzo-p-dioxin-1-ylacetamide?
N-dibenzo-p-dioxin-1-ylacetamide has a molecular weight of 241.25 g/mol, XLogP of 3.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzo-p-dioxin-1-ylacetamide is sourced from PubChem (CID 13308325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).