6H-pyrrolo[3,4-c]carbazole-1,3-dione

C14H8N2O2 — CID 18382004

IUPAC6H-pyrrolo[3,4-c]carbazole-1,3-dione
SMILESO=C1NC(=O)c2c1ccc1[nH]c3ccccc3c21
InChIInChI=1S/C14H8N2O2/c17-13-8-5-6-10-11(12(8)14(18)16-13)7-3-1-2-4-9(7)15-10/h1-6,15H,(H,16,17,18)
InChIKeyAGFYXNWRDSDSRA-UHFFFAOYSA-N
MW236.23 g/mol
LogP2.20
Rot. Bonds

About 6H-pyrrolo[3,4-c]carbazole-1,3-dione

6H-pyrrolo[3,4-c]carbazole-1,3-dione (PubChem CID 18382004) has the molecular formula C14H8N2O2 and a molecular weight of 236.23 g/mol. Its IUPAC name is 6H-pyrrolo[3,4-c]carbazole-1,3-dione.

Molecular Properties

Compound Name6H-pyrrolo[3,4-c]carbazole-1,3-dione
PubChem CID18382004
Molecular FormulaC14H8N2O2
Molecular Weight236.23 g/mol
Exact Mass236.06
IUPAC Name6H-pyrrolo[3,4-c]carbazole-1,3-dione
SMILESO=C1NC(=O)c2c1ccc1[nH]c3ccccc3c21
InChIInChI=1S/C14H8N2O2/c17-13-8-5-6-10-11(12(8)14(18)16-13)7-3-1-2-4-9(7)15-10/h1-6,15H,(H,16,17,18)
InChIKeyAGFYXNWRDSDSRA-UHFFFAOYSA-N
XLogP2.20
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The IUPAC name of 6H-pyrrolo[3,4-c]carbazole-1,3-dione (CID 18382004) is 6H-pyrrolo[3,4-c]carbazole-1,3-dione.
What is the SMILES notation for 6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The canonical SMILES for 6H-pyrrolo[3,4-c]carbazole-1,3-dione is O=C1NC(=O)c2c1ccc1[nH]c3ccccc3c21.
What is the InChIKey of 6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The InChIKey is AGFYXNWRDSDSRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N2O2/c17-13-8-5-6-10-11(12(8)14(18)16-13)7-3-1-2-4-9(7)15-10/h1-6,15H,(H,16,17,18).
What are the key properties of 6H-pyrrolo[3,4-c]carbazole-1,3-dione?
6H-pyrrolo[3,4-c]carbazole-1,3-dione has a molecular weight of 236.23 g/mol, XLogP of 2.20, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-pyrrolo[3,4-c]carbazole-1,3-dione is sourced from PubChem (CID 18382004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).