10-(4-nitrophenyl)-9H-acridine

C19H14N2O2 — CID 12969132

IUPAC10-(4-nitrophenyl)-9H-acridine
SMILESO=[N+]([O-])c1ccc(N2c3ccccc3Cc3ccccc32)cc1
InChIInChI=1S/C19H14N2O2/c22-21(23)17-11-9-16(10-12-17)20-18-7-3-1-5-14(18)13-15-6-2-4-8-19(15)20/h1-12H,13H2
InChIKeyPSSUQYQZMQTABP-UHFFFAOYSA-N
MW302.33 g/mol
LogP4.97
Rot. Bonds2

About 10-(4-nitrophenyl)-9H-acridine

10-(4-nitrophenyl)-9H-acridine (PubChem CID 12969132) has the molecular formula C19H14N2O2 and a molecular weight of 302.33 g/mol. Its IUPAC name is 10-(4-nitrophenyl)-9H-acridine.

Molecular Properties

Compound Name10-(4-nitrophenyl)-9H-acridine
PubChem CID12969132
Molecular FormulaC19H14N2O2
Molecular Weight302.33 g/mol
Exact Mass302.11
IUPAC Name10-(4-nitrophenyl)-9H-acridine
SMILESO=[N+]([O-])c1ccc(N2c3ccccc3Cc3ccccc32)cc1
InChIInChI=1S/C19H14N2O2/c22-21(23)17-11-9-16(10-12-17)20-18-7-3-1-5-14(18)13-15-6-2-4-8-19(15)20/h1-12H,13H2
InChIKeyPSSUQYQZMQTABP-UHFFFAOYSA-N
XLogP4.97
TPSA46.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-phenyl-2-azatetracyclo[15.4.0.03,8.010,15]henicosa-1(21),3,5,7,10,12,14,17,19-nonaene
CID 122432558
10-(4-nitrophenyl)spiro[acridine-9,9'-fluorene]
CID 143268859
2-methyl-1-(4-nitrophenyl)-2,3-dihydroindole
CID 102141492
10-(4-ethylphenyl)-9H-acridine
CID 131970743
5-(9H-acridin-10-yl)-2-[4-(9H-acridin-10-yl)-2-cyanophenyl]benzonitrile
CID 130419594
1-(2-fluorophenyl)-4-(4-nitrophenyl)piperazine
CID 3124723
2-(7-nitro-9H-fluoren-2-yl)isoindole-1,3-dione
CID 3874335
(3E)-3-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)phenyl]methylidene]-1-(4-nitrophenyl)pyrrolidine-2,5-dione
CID 177314921
1,4-bis(4-nitrophenyl)-2,5-diphenylpiperazine
CID 101127745
1-(4-nitrophenyl)-1,3-diazinane-2,4,6-trione
CID 66605218
1-[2-(2-nitrophenyl)phenyl]-3H-indol-2-one
CID 142397302
3-(2,3-dihydroindol-1-yl)-1-(4-fluorophenyl)-4-(4-nitrophenyl)pyrrole-2,5-dione
CID 110542035

Frequently Asked Questions

What is the IUPAC name of 10-(4-nitrophenyl)-9H-acridine?
The IUPAC name of 10-(4-nitrophenyl)-9H-acridine (CID 12969132) is 10-(4-nitrophenyl)-9H-acridine.
What is the SMILES notation for 10-(4-nitrophenyl)-9H-acridine?
The canonical SMILES for 10-(4-nitrophenyl)-9H-acridine is O=[N+]([O-])c1ccc(N2c3ccccc3Cc3ccccc32)cc1.
What is the InChIKey of 10-(4-nitrophenyl)-9H-acridine?
The InChIKey is PSSUQYQZMQTABP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N2O2/c22-21(23)17-11-9-16(10-12-17)20-18-7-3-1-5-14(18)13-15-6-2-4-8-19(15)20/h1-12H,13H2.
What are the key properties of 10-(4-nitrophenyl)-9H-acridine?
10-(4-nitrophenyl)-9H-acridine has a molecular weight of 302.33 g/mol, XLogP of 4.97, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(4-nitrophenyl)-9H-acridine is sourced from PubChem (CID 12969132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).