7H-indeno[4,5-h]isoquinoline

C16H11N — CID 6452601

IUPAC7H-indeno[4,5-h]isoquinoline
SMILESC1=Cc2c(ccc3c4c(ccc23)=CCN=C4)=C1
InChIInChI=1S/C16H11N/c1-2-11-4-7-15-14(13(11)3-1)6-5-12-8-9-17-10-16(12)15/h1-8,10H,9H2
InChIKeyJHCGFTKIMCQMHR-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.86
Rot. Bonds

About 7H-indeno[4,5-h]isoquinoline

7H-indeno[4,5-h]isoquinoline (PubChem CID 6452601) has the molecular formula C16H11N and a molecular weight of 217.27 g/mol. Its IUPAC name is 7H-indeno[4,5-h]isoquinoline.

Molecular Properties

Compound Name7H-indeno[4,5-h]isoquinoline
PubChem CID6452601
Molecular FormulaC16H11N
Molecular Weight217.27 g/mol
Exact Mass217.09
IUPAC Name7H-indeno[4,5-h]isoquinoline
SMILESC1=Cc2c(ccc3c4c(ccc23)=CCN=C4)=C1
InChIInChI=1S/C16H11N/c1-2-11-4-7-15-14(13(11)3-1)6-5-12-8-9-17-10-16(12)15/h1-8,10H,9H2
InChIKeyJHCGFTKIMCQMHR-UHFFFAOYSA-N
XLogP1.86
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 7H-indeno[4,5-h]isoquinoline 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 7H-indeno[4,5-h]isoquinoline?
The IUPAC name of 7H-indeno[4,5-h]isoquinoline (CID 6452601) is 7H-indeno[4,5-h]isoquinoline.
What is the SMILES notation for 7H-indeno[4,5-h]isoquinoline?
The canonical SMILES for 7H-indeno[4,5-h]isoquinoline is C1=Cc2c(ccc3c4c(ccc23)=CCN=C4)=C1.
What is the InChIKey of 7H-indeno[4,5-h]isoquinoline?
The InChIKey is JHCGFTKIMCQMHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N/c1-2-11-4-7-15-14(13(11)3-1)6-5-12-8-9-17-10-16(12)15/h1-8,10H,9H2.
What are the key properties of 7H-indeno[4,5-h]isoquinoline?
7H-indeno[4,5-h]isoquinoline has a molecular weight of 217.27 g/mol, XLogP of 1.86, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7H-indeno[4,5-h]isoquinoline is sourced from PubChem (CID 6452601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).