3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile

C17H9N3O2 — CID 10108095

IUPAC3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile
SMILESN#Cc1c(N)nc(-c2ccco2)c2c1-c1ccccc1C2=O
InChIInChI=1S/C17H9N3O2/c18-8-11-13-9-4-1-2-5-10(9)16(21)14(13)15(20-17(11)19)12-6-3-7-22-12/h1-7H,(H2,19,20)
InChIKeyYTOXAUWWNVYBON-UHFFFAOYSA-N
MW287.28 g/mol
LogP3.01
Rot. Bonds1

About 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile

3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile (PubChem CID 10108095) has the molecular formula C17H9N3O2 and a molecular weight of 287.28 g/mol. Its IUPAC name is 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile.

Molecular Properties

Compound Name3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile
PubChem CID10108095
Molecular FormulaC17H9N3O2
Molecular Weight287.28 g/mol
Exact Mass287.07
IUPAC Name3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile
SMILESN#Cc1c(N)nc(-c2ccco2)c2c1-c1ccccc1C2=O
InChIInChI=1S/C17H9N3O2/c18-8-11-13-9-4-1-2-5-10(9)16(21)14(13)15(20-17(11)19)12-6-3-7-22-12/h1-7H,(H2,19,20)
InChIKeyYTOXAUWWNVYBON-UHFFFAOYSA-N
XLogP3.01
TPSA92.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.28
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile?
The IUPAC name of 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile (CID 10108095) is 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile.
What is the SMILES notation for 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile?
The canonical SMILES for 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile is N#Cc1c(N)nc(-c2ccco2)c2c1-c1ccccc1C2=O.
What is the InChIKey of 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile?
The InChIKey is YTOXAUWWNVYBON-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H9N3O2/c18-8-11-13-9-4-1-2-5-10(9)16(21)14(13)15(20-17(11)19)12-6-3-7-22-12/h1-7H,(H2,19,20).
What are the key properties of 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile?
3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile has a molecular weight of 287.28 g/mol, XLogP of 3.01, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(furan-2-yl)-9-oxoindeno[2,1-c]pyridine-4-carbonitrile is sourced from PubChem (CID 10108095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).