8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile

C14H10N2O2 — CID 79374586

IUPAC8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile
SMILESCOc1ccc2c(c1)-c1[nH]c(=O)c(C#N)cc1C2
InChIInChI=1S/C14H10N2O2/c1-18-11-3-2-8-4-9-5-10(7-15)14(17)16-13(9)12(8)6-11/h2-3,5-6H,4H2,1H3,(H,16,17)
InChIKeyIRGFVIFZWOCOHT-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.83
Rot. Bonds1

About 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile

8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile (PubChem CID 79374586) has the molecular formula C14H10N2O2 and a molecular weight of 238.25 g/mol. Its IUPAC name is 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile.

Molecular Properties

Compound Name8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile
PubChem CID79374586
Molecular FormulaC14H10N2O2
Molecular Weight238.25 g/mol
Exact Mass238.07
IUPAC Name8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile
SMILESCOc1ccc2c(c1)-c1[nH]c(=O)c(C#N)cc1C2
InChIInChI=1S/C14H10N2O2/c1-18-11-3-2-8-4-9-5-10(7-15)14(17)16-13(9)12(8)6-11/h2-3,5-6H,4H2,1H3,(H,16,17)
InChIKeyIRGFVIFZWOCOHT-UHFFFAOYSA-N
XLogP1.83
TPSA65.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile?
The IUPAC name of 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile (CID 79374586) is 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile.
What is the SMILES notation for 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile?
The canonical SMILES for 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile is COc1ccc2c(c1)-c1[nH]c(=O)c(C#N)cc1C2.
What is the InChIKey of 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile?
The InChIKey is IRGFVIFZWOCOHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O2/c1-18-11-3-2-8-4-9-5-10(7-15)14(17)16-13(9)12(8)6-11/h2-3,5-6H,4H2,1H3,(H,16,17).
What are the key properties of 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile?
8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile has a molecular weight of 238.25 g/mol, XLogP of 1.83, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2-oxo-1,5-dihydroindeno[1,2-b]pyridine-3-carbonitrile is sourced from PubChem (CID 79374586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).