9H-indeno[1,2-b]pyrazine-2-carbonitrile

C12H7N3 — CID 67068060

IUPAC9H-indeno[1,2-b]pyrazine-2-carbonitrile
SMILESN#Cc1cnc2c(n1)Cc1ccccc1-2
InChIInChI=1S/C12H7N3/c13-6-9-7-14-12-10-4-2-1-3-8(10)5-11(12)15-9/h1-4,7H,5H2
InChIKeyKTWOENWOHJATMF-UHFFFAOYSA-N
MW193.21 g/mol
LogP1.92
Rot. Bonds

About 9H-indeno[1,2-b]pyrazine-2-carbonitrile

9H-indeno[1,2-b]pyrazine-2-carbonitrile (PubChem CID 67068060) has the molecular formula C12H7N3 and a molecular weight of 193.21 g/mol. Its IUPAC name is 9H-indeno[1,2-b]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name9H-indeno[1,2-b]pyrazine-2-carbonitrile
PubChem CID67068060
Molecular FormulaC12H7N3
Molecular Weight193.21 g/mol
Exact Mass193.06
IUPAC Name9H-indeno[1,2-b]pyrazine-2-carbonitrile
SMILESN#Cc1cnc2c(n1)Cc1ccccc1-2
InChIInChI=1S/C12H7N3/c13-6-9-7-14-12-10-4-2-1-3-8(10)5-11(12)15-9/h1-4,7H,5H2
InChIKeyKTWOENWOHJATMF-UHFFFAOYSA-N
XLogP1.92
TPSA49.57 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9H-indeno[1,2-b]pyrazine-2-carbonitrile?
The IUPAC name of 9H-indeno[1,2-b]pyrazine-2-carbonitrile (CID 67068060) is 9H-indeno[1,2-b]pyrazine-2-carbonitrile.
What is the SMILES notation for 9H-indeno[1,2-b]pyrazine-2-carbonitrile?
The canonical SMILES for 9H-indeno[1,2-b]pyrazine-2-carbonitrile is N#Cc1cnc2c(n1)Cc1ccccc1-2.
What is the InChIKey of 9H-indeno[1,2-b]pyrazine-2-carbonitrile?
The InChIKey is KTWOENWOHJATMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7N3/c13-6-9-7-14-12-10-4-2-1-3-8(10)5-11(12)15-9/h1-4,7H,5H2.
What are the key properties of 9H-indeno[1,2-b]pyrazine-2-carbonitrile?
9H-indeno[1,2-b]pyrazine-2-carbonitrile has a molecular weight of 193.21 g/mol, XLogP of 1.92, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-indeno[1,2-b]pyrazine-2-carbonitrile is sourced from PubChem (CID 67068060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).