N-(6-oxobenzo[c]chromen-7-yl)acetamide

C15H11NO3 — CID 69024767

IUPACN-(6-oxobenzo[c]chromen-7-yl)acetamide
SMILESCC(=O)Nc1cccc2c1c(=O)oc1ccccc12
InChIInChI=1S/C15H11NO3/c1-9(17)16-12-7-4-6-11-10-5-2-3-8-13(10)19-15(18)14(11)12/h2-8H,1H3,(H,16,17)
InChIKeyBQQUKMKWBQXRLA-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.90
Rot. Bonds1

About N-(6-oxobenzo[c]chromen-7-yl)acetamide

N-(6-oxobenzo[c]chromen-7-yl)acetamide (PubChem CID 69024767) has the molecular formula C15H11NO3 and a molecular weight of 253.26 g/mol. Its IUPAC name is N-(6-oxobenzo[c]chromen-7-yl)acetamide.

Molecular Properties

Compound NameN-(6-oxobenzo[c]chromen-7-yl)acetamide
PubChem CID69024767
Molecular FormulaC15H11NO3
Molecular Weight253.26 g/mol
Exact Mass253.07
IUPAC NameN-(6-oxobenzo[c]chromen-7-yl)acetamide
SMILESCC(=O)Nc1cccc2c1c(=O)oc1ccccc12
InChIInChI=1S/C15H11NO3/c1-9(17)16-12-7-4-6-11-10-5-2-3-8-13(10)19-15(18)14(11)12/h2-8H,1H3,(H,16,17)
InChIKeyBQQUKMKWBQXRLA-UHFFFAOYSA-N
XLogP2.90
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

6-oxobenzo[c]chromene-7-carboxylic acid
CID 14083219
N-(3-hydroxy-4-oxo-2-phenylchromen-5-yl)acetamide
CID 141231274
N-dibenzofuran-4-ylacetamide;furan-3-amine
CID 130442781
N-[2-(2-oxochromen-3-yl)phenyl]acetamide
CID 164684022
N-(1-ethyl-2,5-dioxochromeno[4,3-b]pyridin-3-yl)acetamide
CID 11437974
naphtho[1,2-c]chromen-5-one
CID 102526290
8,17-dioxaheptacyclo[22.6.6.02,7.010,15.018,23.025,30.031,36]hexatriaconta-1(31),2,4,6,10,12,14,18,20,22,24(36),25,27,29,32,34-hexadecaene-9,16-dione
CID 59760668
N-dibenzofuran-4-ylpropanamide
CID 138533625
7-chloro-8-hydroxybenzo[c]chromen-6-one
CID 164598055
4-hydroxy-N-naphthalen-1-yl-2-oxochromene-3-carboxamide
CID 54748267
2-cyano-N-dibenzofuran-1-ylacetamide
CID 168520368
7-[3-(6-oxobenzo[c]chromen-7-yl)-5-phenylphenyl]benzo[c]chromen-6-one
CID 121242464

Frequently Asked Questions

What is the IUPAC name of N-(6-oxobenzo[c]chromen-7-yl)acetamide?
The IUPAC name of N-(6-oxobenzo[c]chromen-7-yl)acetamide (CID 69024767) is N-(6-oxobenzo[c]chromen-7-yl)acetamide.
What is the SMILES notation for N-(6-oxobenzo[c]chromen-7-yl)acetamide?
The canonical SMILES for N-(6-oxobenzo[c]chromen-7-yl)acetamide is CC(=O)Nc1cccc2c1c(=O)oc1ccccc12.
What is the InChIKey of N-(6-oxobenzo[c]chromen-7-yl)acetamide?
The InChIKey is BQQUKMKWBQXRLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO3/c1-9(17)16-12-7-4-6-11-10-5-2-3-8-13(10)19-15(18)14(11)12/h2-8H,1H3,(H,16,17).
What are the key properties of N-(6-oxobenzo[c]chromen-7-yl)acetamide?
N-(6-oxobenzo[c]chromen-7-yl)acetamide has a molecular weight of 253.26 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxobenzo[c]chromen-7-yl)acetamide is sourced from PubChem (CID 69024767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).