indolo[3,3a-c]isoquinoline

C15H10N2 — CID 171665717

IUPACindolo[3,3a-c]isoquinoline
SMILESC1=CC2=NC=C3N=Cc4ccccc4C32C=C1
InChIInChI=1S/C15H10N2/c1-2-6-12-11(5-1)9-16-14-10-17-13-7-3-4-8-15(12,13)14/h1-10H
InChIKeySGPGPKANTQBSRG-UHFFFAOYSA-N
MW218.26 g/mol
LogP2.78
Rot. Bonds

About indolo[3,3a-c]isoquinoline

indolo[3,3a-c]isoquinoline (PubChem CID 171665717) has the molecular formula C15H10N2 and a molecular weight of 218.26 g/mol. Its IUPAC name is indolo[3,3a-c]isoquinoline.

Molecular Properties

Compound Nameindolo[3,3a-c]isoquinoline
PubChem CID171665717
Molecular FormulaC15H10N2
Molecular Weight218.26 g/mol
Exact Mass218.08
IUPAC Nameindolo[3,3a-c]isoquinoline
SMILESC1=CC2=NC=C3N=Cc4ccccc4C32C=C1
InChIInChI=1S/C15H10N2/c1-2-6-12-11(5-1)9-16-14-10-17-13-7-3-4-8-15(12,13)14/h1-10H
InChIKeySGPGPKANTQBSRG-UHFFFAOYSA-N
XLogP2.78
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of indolo[3,3a-c]isoquinoline?
The IUPAC name of indolo[3,3a-c]isoquinoline (CID 171665717) is indolo[3,3a-c]isoquinoline.
What is the SMILES notation for indolo[3,3a-c]isoquinoline?
The canonical SMILES for indolo[3,3a-c]isoquinoline is C1=CC2=NC=C3N=Cc4ccccc4C32C=C1.
What is the InChIKey of indolo[3,3a-c]isoquinoline?
The InChIKey is SGPGPKANTQBSRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2/c1-2-6-12-11(5-1)9-16-14-10-17-13-7-3-4-8-15(12,13)14/h1-10H.
What are the key properties of indolo[3,3a-c]isoquinoline?
indolo[3,3a-c]isoquinoline has a molecular weight of 218.26 g/mol, XLogP of 2.78, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for indolo[3,3a-c]isoquinoline is sourced from PubChem (CID 171665717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).