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

C15H10N2O3 — CID 11843684

IUPAC9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione
SMILESCOc1ccc2[nH]c3ccc4c(c3c2c1)C(=O)NC4=O
InChIInChI=1S/C15H10N2O3/c1-20-7-2-4-10-9(6-7)12-11(16-10)5-3-8-13(12)15(19)17-14(8)18/h2-6,16H,1H3,(H,17,18,19)
InChIKeyJDYAUMBHBMIRSC-UHFFFAOYSA-N
MW266.26 g/mol
LogP2.21
Rot. Bonds1

About 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione

9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione (PubChem CID 11843684) has the molecular formula C15H10N2O3 and a molecular weight of 266.26 g/mol. Its IUPAC name is 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione.

Molecular Properties

Compound Name9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione
PubChem CID11843684
Molecular FormulaC15H10N2O3
Molecular Weight266.26 g/mol
Exact Mass266.07
IUPAC Name9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione
SMILESCOc1ccc2[nH]c3ccc4c(c3c2c1)C(=O)NC4=O
InChIInChI=1S/C15H10N2O3/c1-20-7-2-4-10-9(6-7)12-11(16-10)5-3-8-13(12)15(19)17-14(8)18/h2-6,16H,1H3,(H,17,18,19)
InChIKeyJDYAUMBHBMIRSC-UHFFFAOYSA-N
XLogP2.21
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The IUPAC name of 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione (CID 11843684) is 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione.
What is the SMILES notation for 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The canonical SMILES for 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione is COc1ccc2[nH]c3ccc4c(c3c2c1)C(=O)NC4=O.
What is the InChIKey of 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The InChIKey is JDYAUMBHBMIRSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10N2O3/c1-20-7-2-4-10-9(6-7)12-11(16-10)5-3-8-13(12)15(19)17-14(8)18/h2-6,16H,1H3,(H,17,18,19).
What are the key properties of 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione?
9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione has a molecular weight of 266.26 g/mol, XLogP of 2.21, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methoxy-6H-pyrrolo[3,4-c]carbazole-1,3-dione is sourced from PubChem (CID 11843684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).