9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione

C19H11N3O3 — CID 11843430

IUPAC9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione
SMILESO=C1NC(=O)c2c1c(-c1ccncc1)cc1[nH]c3ccc(O)cc3c21
InChIInChI=1S/C19H11N3O3/c23-10-1-2-13-12(7-10)15-14(21-13)8-11(9-3-5-20-6-4-9)16-17(15)19(25)22-18(16)24/h1-8,21,23H,(H,22,24,25)
InChIKeyWDFNHVIGTMWPQV-UHFFFAOYSA-N
MW329.31 g/mol
LogP2.97
Rot. Bonds1

About 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione

9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione (PubChem CID 11843430) has the molecular formula C19H11N3O3 and a molecular weight of 329.31 g/mol. Its IUPAC name is 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione.

Molecular Properties

Compound Name9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione
PubChem CID11843430
Molecular FormulaC19H11N3O3
Molecular Weight329.31 g/mol
Exact Mass329.08
IUPAC Name9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione
SMILESO=C1NC(=O)c2c1c(-c1ccncc1)cc1[nH]c3ccc(O)cc3c21
InChIInChI=1S/C19H11N3O3/c23-10-1-2-13-12(7-10)15-14(21-13)8-11(9-3-5-20-6-4-9)16-17(15)19(25)22-18(16)24/h1-8,21,23H,(H,22,24,25)
InChIKeyWDFNHVIGTMWPQV-UHFFFAOYSA-N
XLogP2.97
TPSA95.08 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.31
LogP ≤ 52.97
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The IUPAC name of 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione (CID 11843430) is 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione.
What is the SMILES notation for 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The canonical SMILES for 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione is O=C1NC(=O)c2c1c(-c1ccncc1)cc1[nH]c3ccc(O)cc3c21.
What is the InChIKey of 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione?
The InChIKey is WDFNHVIGTMWPQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H11N3O3/c23-10-1-2-13-12(7-10)15-14(21-13)8-11(9-3-5-20-6-4-9)16-17(15)19(25)22-18(16)24/h1-8,21,23H,(H,22,24,25).
What are the key properties of 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione?
9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione has a molecular weight of 329.31 g/mol, XLogP of 2.97, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-hydroxy-4-pyridin-4-yl-6H-pyrrolo[3,4-c]carbazole-1,3-dione is sourced from PubChem (CID 11843430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).