2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide

C15H11NO4 — CID 782946

IUPAC2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide
SMILESNC(=O)COc1ccc2c(c1)oc(=O)c1ccccc12
InChIInChI=1S/C15H11NO4/c16-14(17)8-19-9-5-6-11-10-3-1-2-4-12(10)15(18)20-13(11)7-9/h1-7H,8H2,(H2,16,17)
InChIKeyXCSROMRNYAPQNT-UHFFFAOYSA-N
MW269.26 g/mol
LogP1.81
Rot. Bonds3

About 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide

2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide (PubChem CID 782946) has the molecular formula C15H11NO4 and a molecular weight of 269.26 g/mol. Its IUPAC name is 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide.

Molecular Properties

Compound Name2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide
PubChem CID782946
Molecular FormulaC15H11NO4
Molecular Weight269.26 g/mol
Exact Mass269.07
IUPAC Name2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide
SMILESNC(=O)COc1ccc2c(c1)oc(=O)c1ccccc12
InChIInChI=1S/C15H11NO4/c16-14(17)8-19-9-5-6-11-10-3-1-2-4-12(10)15(18)20-13(11)7-9/h1-7H,8H2,(H2,16,17)
InChIKeyXCSROMRNYAPQNT-UHFFFAOYSA-N
XLogP1.81
TPSA82.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.26
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cumarine', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

3-(2-methylprop-2-enoxy)benzo[c]chromen-6-one
CID 721848
3-(2-chloroprop-2-enoxy)benzo[c]chromen-6-one
CID 806874
propan-2-yl 2-(6-oxobenzo[c]chromen-3-yl)oxyacetate
CID 701972
N-benzyl-2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide
CID 171617266
2-[1-(2-amino-2-oxoethoxy)-6-oxobenzo[c]chromen-3-yl]oxyacetamide
CID 726147
2-[[2-(6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]butanoic acid
CID 3322999
3-phenylmethoxybenzo[c]chromen-6-one
CID 2787564
2-(6-oxobenzo[c]chromen-3-yl)oxy-N-(2-pyridin-2-ylethyl)acetamide
CID 156790060
3-[2-(3a,4-dihydro-1,3-benzodioxol-5-yl)-2-oxoethoxy]benzo[c]chromen-6-one
CID 123262895
3-[(2-chlorophenyl)methoxy]benzo[c]chromen-6-one
CID 746170
methyl (2S)-2-(6-oxobenzo[c]chromen-3-yl)oxybutanoate
CID 7085258
3-[(2S)-3-oxobutan-2-yl]oxybenzo[c]chromen-6-one
CID 914972

Frequently Asked Questions

What is the IUPAC name of 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide?
The IUPAC name of 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide (CID 782946) is 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide.
What is the SMILES notation for 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide?
The canonical SMILES for 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide is NC(=O)COc1ccc2c(c1)oc(=O)c1ccccc12.
What is the InChIKey of 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide?
The InChIKey is XCSROMRNYAPQNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO4/c16-14(17)8-19-9-5-6-11-10-3-1-2-4-12(10)15(18)20-13(11)7-9/h1-7H,8H2,(H2,16,17).
What are the key properties of 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide?
2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide has a molecular weight of 269.26 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-oxobenzo[c]chromen-3-yl)oxyacetamide is sourced from PubChem (CID 782946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).