2-methyl-6-nitro-10H-acridin-9-one

C14H10N2O3 — CID 154179171

IUPAC2-methyl-6-nitro-10H-acridin-9-one
SMILESCc1ccc2[nH]c3cc([N+](=O)[O-])ccc3c(=O)c2c1
InChIInChI=1S/C14H10N2O3/c1-8-2-5-12-11(6-8)14(17)10-4-3-9(16(18)19)7-13(10)15-12/h2-7H,1H3,(H,15,17)
InChIKeyNQDLIVYWWRNJJI-UHFFFAOYSA-N
MW254.25 g/mol
LogP2.90
Rot. Bonds1

About 2-methyl-6-nitro-10H-acridin-9-one

2-methyl-6-nitro-10H-acridin-9-one (PubChem CID 154179171) has the molecular formula C14H10N2O3 and a molecular weight of 254.25 g/mol. Its IUPAC name is 2-methyl-6-nitro-10H-acridin-9-one.

Molecular Properties

Compound Name2-methyl-6-nitro-10H-acridin-9-one
PubChem CID154179171
Molecular FormulaC14H10N2O3
Molecular Weight254.25 g/mol
Exact Mass254.07
IUPAC Name2-methyl-6-nitro-10H-acridin-9-one
SMILESCc1ccc2[nH]c3cc([N+](=O)[O-])ccc3c(=O)c2c1
InChIInChI=1S/C14H10N2O3/c1-8-2-5-12-11(6-8)14(17)10-4-3-9(16(18)19)7-13(10)15-12/h2-7H,1H3,(H,15,17)
InChIKeyNQDLIVYWWRNJJI-UHFFFAOYSA-N
XLogP2.90
TPSA76.00 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 52.90
H-Bond Donors ≤ 51
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'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

3-methyl-6-nitro-9H-carbazole
CID 58160212
3,9-dimethyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
CID 59728395
2,7-dimethyl-10H-acridin-9-one
CID 13293445
2-nitro-10H-acridin-9-one;sulfuryl dichloride
CID 159861980
2-methyl-7-nitro-1H-quinolin-4-one
CID 10703350
9-nitro-3,6-dihydro-2H-[1,4]dioxino[2,3-b]acridin-11-one
CID 11695086
3-methyl-7-nitro-1H-quinolin-4-one
CID 10560102
2-chloro-9-methyl-5,12-dihydroquinolino[2,3-b]acridine-7,14-dione
CID 59775439
7-nitro-1H-quinazoline-2,4-dione
CID 3398113
2,8-dimethyl-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione
CID 24764365
3,8-dinitro-11,12-dihydroindolo[2,3-a]carbazole
CID 11653124
2-methoxy-7-methyl-10H-acridin-9-one
CID 24773760

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-nitro-10H-acridin-9-one?
The IUPAC name of 2-methyl-6-nitro-10H-acridin-9-one (CID 154179171) is 2-methyl-6-nitro-10H-acridin-9-one.
What is the SMILES notation for 2-methyl-6-nitro-10H-acridin-9-one?
The canonical SMILES for 2-methyl-6-nitro-10H-acridin-9-one is Cc1ccc2[nH]c3cc([N+](=O)[O-])ccc3c(=O)c2c1.
What is the InChIKey of 2-methyl-6-nitro-10H-acridin-9-one?
The InChIKey is NQDLIVYWWRNJJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3/c1-8-2-5-12-11(6-8)14(17)10-4-3-9(16(18)19)7-13(10)15-12/h2-7H,1H3,(H,15,17).
What are the key properties of 2-methyl-6-nitro-10H-acridin-9-one?
2-methyl-6-nitro-10H-acridin-9-one has a molecular weight of 254.25 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-nitro-10H-acridin-9-one is sourced from PubChem (CID 154179171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).