12H-isochromeno[4,3-c]cinnoline

C15H10N2O — CID 170972479

IUPAC12H-isochromeno[4,3-c]cinnoline
SMILESc1ccc2c(c1)COc1c-2nnc2ccccc12
InChIInChI=1S/C15H10N2O/c1-2-6-11-10(5-1)9-18-15-12-7-3-4-8-13(12)16-17-14(11)15/h1-8H,9H2
InChIKeyYADOKMHKUJKMBZ-UHFFFAOYSA-N
MW234.26 g/mol
LogP3.19
Rot. Bonds

About 12H-isochromeno[4,3-c]cinnoline

12H-isochromeno[4,3-c]cinnoline (PubChem CID 170972479) has the molecular formula C15H10N2O and a molecular weight of 234.26 g/mol. Its IUPAC name is 12H-isochromeno[4,3-c]cinnoline.

Molecular Properties

Compound Name12H-isochromeno[4,3-c]cinnoline
PubChem CID170972479
Molecular FormulaC15H10N2O
Molecular Weight234.26 g/mol
Exact Mass234.08
IUPAC Name12H-isochromeno[4,3-c]cinnoline
SMILESc1ccc2c(c1)COc1c-2nnc2ccccc12
InChIInChI=1S/C15H10N2O/c1-2-6-11-10(5-1)9-18-15-12-7-3-4-8-13(12)16-17-14(11)15/h1-8H,9H2
InChIKeyYADOKMHKUJKMBZ-UHFFFAOYSA-N
XLogP3.19
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 12H-isochromeno[4,3-c]cinnoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 12H-isochromeno[4,3-c]cinnoline?
The IUPAC name of 12H-isochromeno[4,3-c]cinnoline (CID 170972479) is 12H-isochromeno[4,3-c]cinnoline.
What is the SMILES notation for 12H-isochromeno[4,3-c]cinnoline?
The canonical SMILES for 12H-isochromeno[4,3-c]cinnoline is c1ccc2c(c1)COc1c-2nnc2ccccc12.
What is the InChIKey of 12H-isochromeno[4,3-c]cinnoline?
The InChIKey is YADOKMHKUJKMBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O/c1-2-6-11-10(5-1)9-18-15-12-7-3-4-8-13(12)16-17-14(11)15/h1-8H,9H2.
What are the key properties of 12H-isochromeno[4,3-c]cinnoline?
12H-isochromeno[4,3-c]cinnoline has a molecular weight of 234.26 g/mol, XLogP of 3.19, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 12H-isochromeno[4,3-c]cinnoline is sourced from PubChem (CID 170972479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).