1H-indeno[1,2-c]isoquinoline

C16H11N — CID 87368268

IUPAC1H-indeno[1,2-c]isoquinoline
SMILESC1=CCc2c3c(ncc2=C1)=c1ccccc1=C3
InChIInChI=1S/C16H11N/c1-4-8-14-11(5-1)9-15-13-7-3-2-6-12(13)10-17-16(14)15/h1-6,8-10H,7H2
InChIKeyLPERROAAUIVIRJ-UHFFFAOYSA-N
MW217.27 g/mol
LogP1.40
Rot. Bonds

About 1H-indeno[1,2-c]isoquinoline

1H-indeno[1,2-c]isoquinoline (PubChem CID 87368268) has the molecular formula C16H11N and a molecular weight of 217.27 g/mol. Its IUPAC name is 1H-indeno[1,2-c]isoquinoline.

Molecular Properties

Compound Name1H-indeno[1,2-c]isoquinoline
PubChem CID87368268
Molecular FormulaC16H11N
Molecular Weight217.27 g/mol
Exact Mass217.09
IUPAC Name1H-indeno[1,2-c]isoquinoline
SMILESC1=CCc2c3c(ncc2=C1)=c1ccccc1=C3
InChIInChI=1S/C16H11N/c1-4-8-14-11(5-1)9-15-13-7-3-2-6-12(13)10-17-16(14)15/h1-6,8-10H,7H2
InChIKeyLPERROAAUIVIRJ-UHFFFAOYSA-N
XLogP1.40
TPSA12.89 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 ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1H-indeno[1,2-c]isoquinoline?
The IUPAC name of 1H-indeno[1,2-c]isoquinoline (CID 87368268) is 1H-indeno[1,2-c]isoquinoline.
What is the SMILES notation for 1H-indeno[1,2-c]isoquinoline?
The canonical SMILES for 1H-indeno[1,2-c]isoquinoline is C1=CCc2c3c(ncc2=C1)=c1ccccc1=C3.
What is the InChIKey of 1H-indeno[1,2-c]isoquinoline?
The InChIKey is LPERROAAUIVIRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N/c1-4-8-14-11(5-1)9-15-13-7-3-2-6-12(13)10-17-16(14)15/h1-6,8-10H,7H2.
What are the key properties of 1H-indeno[1,2-c]isoquinoline?
1H-indeno[1,2-c]isoquinoline has a molecular weight of 217.27 g/mol, XLogP of 1.40, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-indeno[1,2-c]isoquinoline is sourced from PubChem (CID 87368268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).