9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one

C13H12N2O2 — CID 54496209

IUPAC9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one
SMILESO=C1CCCc2nc3ccccc3c(NO)c21
InChIInChI=1S/C13H12N2O2/c16-11-7-3-6-10-12(11)13(15-17)8-4-1-2-5-9(8)14-10/h1-2,4-5,17H,3,6-7H2,(H,14,15)
InChIKeyXZHKANYXJRIUPA-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.55
Rot. Bonds1

About 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one

9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one (PubChem CID 54496209) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one.

Molecular Properties

Compound Name9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one
PubChem CID54496209
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC Name9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one
SMILESO=C1CCCc2nc3ccccc3c(NO)c21
InChIInChI=1S/C13H12N2O2/c16-11-7-3-6-10-12(11)13(15-17)8-4-1-2-5-9(8)14-10/h1-2,4-5,17H,3,6-7H2,(H,14,15)
InChIKeyXZHKANYXJRIUPA-UHFFFAOYSA-N
XLogP2.55
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

9-[(2-hydroxy-2-phenylethyl)amino]-3,4-dihydro-2H-acridin-1-one
CID 54559789
3-(hydroxymethyl)-9-phenyl-6,7-dihydro-5H-pyrazolo[5,1-b]quinazolin-8-one
CID 123668562
N,N'-bis(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)hexane-1,6-diamine
CID 15490813
2,3-dihydro-1H-cyclopenta[b]quinoline-9-carbohydrazide
CID 14385689
N-propyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 62202711
4-amino-2-phenyl-7,8-dihydro-6H-quinazolin-5-one
CID 10868375
6-phenyl-3,4-dihydro-2H-phenanthridine-1,7,10-trione
CID 53376161
3,4-dihydro-2H-acridin-1-one;dihydrochloride
CID 142633980
9-(ethylamino)-3,3-dimethyl-2,4-dihydroacridin-1-one;hydrochloride
CID 44668985
[2-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-ylamino)-2-oxoethyl]-diethylazanium
CID 7046168
N-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-2-(dimethylamino)acetamide;oxalic acid
CID 44784201
N-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-2-pyrrolidin-1-ylacetamide;oxalic acid
CID 6456059

Frequently Asked Questions

What is the IUPAC name of 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one?
The IUPAC name of 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one (CID 54496209) is 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one.
What is the SMILES notation for 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one?
The canonical SMILES for 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one is O=C1CCCc2nc3ccccc3c(NO)c21.
What is the InChIKey of 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one?
The InChIKey is XZHKANYXJRIUPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c16-11-7-3-6-10-12(11)13(15-17)8-4-1-2-5-9(8)14-10/h1-2,4-5,17H,3,6-7H2,(H,14,15).
What are the key properties of 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one?
9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one has a molecular weight of 228.25 g/mol, XLogP of 2.55, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(hydroxyamino)-3,4-dihydro-2H-acridin-1-one is sourced from PubChem (CID 54496209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).