N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide

C14H13N3O2 — CID 10244077

IUPACN-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)-c1cc(=O)[nH]nc1CC2
InChIInChI=1S/C14H13N3O2/c1-8(18)15-10-4-2-9-3-5-13-12(11(9)6-10)7-14(19)17-16-13/h2,4,6-7H,3,5H2,1H3,(H,15,18)(H,17,19)
InChIKeyDUKKCHCFGYNQEG-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.49
Rot. Bonds1

About N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide

N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide (PubChem CID 10244077) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide.

Molecular Properties

Compound NameN-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide
PubChem CID10244077
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC NameN-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide
SMILESCC(=O)Nc1ccc2c(c1)-c1cc(=O)[nH]nc1CC2
InChIInChI=1S/C14H13N3O2/c1-8(18)15-10-4-2-9-3-5-13-12(11(9)6-10)7-14(19)17-16-13/h2,4,6-7H,3,5H2,1H3,(H,15,18)(H,17,19)
InChIKeyDUKKCHCFGYNQEG-UHFFFAOYSA-N
XLogP1.49
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide?
The IUPAC name of N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide (CID 10244077) is N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide.
What is the SMILES notation for N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide?
The canonical SMILES for N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide is CC(=O)Nc1ccc2c(c1)-c1cc(=O)[nH]nc1CC2.
What is the InChIKey of N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide?
The InChIKey is DUKKCHCFGYNQEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c1-8(18)15-10-4-2-9-3-5-13-12(11(9)6-10)7-14(19)17-16-13/h2,4,6-7H,3,5H2,1H3,(H,15,18)(H,17,19).
What are the key properties of N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide?
N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide has a molecular weight of 255.28 g/mol, XLogP of 1.49, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-oxo-5,6-dihydro-3H-benzo[f]cinnolin-9-yl)acetamide is sourced from PubChem (CID 10244077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).