1-(9H-carbazol-1-yl)pyrrole-2,5-dione

C16H10N2O2 — CID 175123803

IUPAC1-(9H-carbazol-1-yl)pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C16H10N2O2/c19-14-8-9-15(20)18(14)13-7-3-5-11-10-4-1-2-6-12(10)17-16(11)13/h1-9,17H
InChIKeyQOPSIHZCHDTCJS-UHFFFAOYSA-N
MW262.27 g/mol
LogP2.75
Rot. Bonds1

About 1-(9H-carbazol-1-yl)pyrrole-2,5-dione

1-(9H-carbazol-1-yl)pyrrole-2,5-dione (PubChem CID 175123803) has the molecular formula C16H10N2O2 and a molecular weight of 262.27 g/mol. Its IUPAC name is 1-(9H-carbazol-1-yl)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(9H-carbazol-1-yl)pyrrole-2,5-dione
PubChem CID175123803
Molecular FormulaC16H10N2O2
Molecular Weight262.27 g/mol
Exact Mass262.07
IUPAC Name1-(9H-carbazol-1-yl)pyrrole-2,5-dione
SMILESO=C1C=CC(=O)N1c1cccc2c1[nH]c1ccccc12
InChIInChI=1S/C16H10N2O2/c19-14-8-9-15(20)18(14)13-7-3-5-11-10-4-1-2-6-12(10)17-16(11)13/h1-9,17H
InChIKeyQOPSIHZCHDTCJS-UHFFFAOYSA-N
XLogP2.75
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.27
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(9H-carbazol-1-yl)isoindole-1,3-dione
CID 175293328
9H-carbazole-1-carbaldehyde
CID 11745551
1-[2-(9H-carbazol-1-yl)phenyl]-9H-carbazole
CID 66618059
9H-carbazol-1-ylboronic acid
CID 53421584
9H-carbazole
CID 66668984
1-[4-[4-[4-[4-(9H-carbazol-1-yl)phenyl]phenyl]phenyl]phenyl]-9H-carbazole
CID 175958773
1-[9H-carbazol-1-yl(phenyl)phosphoryl]-9H-carbazole
CID 156587859
2-(9H-carbazole-1-carbonyl)benzoic acid
CID 54401477
1-fluoranthen-3-yl-9H-carbazole
CID 142752993
9H-carbazole-1-sulfonamide
CID 18617392
9H-carbazol-1-ylmethanol
CID 10987211
2-(9H-carbazol-1-yl)-2,2-difluoroacetic acid
CID 175399691

Frequently Asked Questions

What is the IUPAC name of 1-(9H-carbazol-1-yl)pyrrole-2,5-dione?
The IUPAC name of 1-(9H-carbazol-1-yl)pyrrole-2,5-dione (CID 175123803) is 1-(9H-carbazol-1-yl)pyrrole-2,5-dione.
What is the SMILES notation for 1-(9H-carbazol-1-yl)pyrrole-2,5-dione?
The canonical SMILES for 1-(9H-carbazol-1-yl)pyrrole-2,5-dione is O=C1C=CC(=O)N1c1cccc2c1[nH]c1ccccc12.
What is the InChIKey of 1-(9H-carbazol-1-yl)pyrrole-2,5-dione?
The InChIKey is QOPSIHZCHDTCJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10N2O2/c19-14-8-9-15(20)18(14)13-7-3-5-11-10-4-1-2-6-12(10)17-16(11)13/h1-9,17H.
What are the key properties of 1-(9H-carbazol-1-yl)pyrrole-2,5-dione?
1-(9H-carbazol-1-yl)pyrrole-2,5-dione has a molecular weight of 262.27 g/mol, XLogP of 2.75, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-carbazol-1-yl)pyrrole-2,5-dione is sourced from PubChem (CID 175123803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).