6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile

C15H8N4O — CID 155514671

IUPAC6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile
SMILESCc1cc2c(cc1C)-c1nc(C#N)c(C#N)nc1C2=O
InChIInChI=1S/C15H8N4O/c1-7-3-9-10(4-8(7)2)15(20)14-13(9)18-11(5-16)12(6-17)19-14/h3-4H,1-2H3
InChIKeyNOSOMTCXQBUWHE-UHFFFAOYSA-N
MW260.26 g/mol
LogP2.05
Rot. Bonds

About 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile

6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile (PubChem CID 155514671) has the molecular formula C15H8N4O and a molecular weight of 260.26 g/mol. Its IUPAC name is 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile.

Molecular Properties

Compound Name6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile
PubChem CID155514671
Molecular FormulaC15H8N4O
Molecular Weight260.26 g/mol
Exact Mass260.07
IUPAC Name6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile
SMILESCc1cc2c(cc1C)-c1nc(C#N)c(C#N)nc1C2=O
InChIInChI=1S/C15H8N4O/c1-7-3-9-10(4-8(7)2)15(20)14-13(9)18-11(5-16)12(6-17)19-14/h3-4H,1-2H3
InChIKeyNOSOMTCXQBUWHE-UHFFFAOYSA-N
XLogP2.05
TPSA90.43 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile?
The IUPAC name of 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile (CID 155514671) is 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile.
What is the SMILES notation for 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile?
The canonical SMILES for 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile is Cc1cc2c(cc1C)-c1nc(C#N)c(C#N)nc1C2=O.
What is the InChIKey of 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile?
The InChIKey is NOSOMTCXQBUWHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8N4O/c1-7-3-9-10(4-8(7)2)15(20)14-13(9)18-11(5-16)12(6-17)19-14/h3-4H,1-2H3.
What are the key properties of 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile?
6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile has a molecular weight of 260.26 g/mol, XLogP of 2.05, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-9-oxoindeno[1,2-b]pyrazine-2,3-dicarbonitrile is sourced from PubChem (CID 155514671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).