10H-acridin-9-one;ethane

C17H21NO — CID 91525380

IUPAC10H-acridin-9-one;ethane
SMILESCC.CC.O=c1c2ccccc2[nH]c2ccccc12
InChIInChI=1S/C13H9NO.2C2H6/c15-13-9-5-1-3-7-11(9)14-12-8-4-2-6-10(12)13;2*1-2/h1-8H,(H,14,15);2*1-2H3
InChIKeyUXQZJHKBZSAMJP-UHFFFAOYSA-N
MW255.36 g/mol
LogP4.73
Rot. Bonds

About 10H-acridin-9-one;ethane

10H-acridin-9-one;ethane (PubChem CID 91525380) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is 10H-acridin-9-one;ethane.

Molecular Properties

Compound Name10H-acridin-9-one;ethane
PubChem CID91525380
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name10H-acridin-9-one;ethane
SMILESCC.CC.O=c1c2ccccc2[nH]c2ccccc12
InChIInChI=1S/C13H9NO.2C2H6/c15-13-9-5-1-3-7-11(9)14-12-8-4-2-6-10(12)13;2*1-2/h1-8H,(H,14,15);2*1-2H3
InChIKeyUXQZJHKBZSAMJP-UHFFFAOYSA-N
XLogP4.73
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

10H-acridin-9-one
CID 22753806
5,12-dihydroquinolino[2,3-b]acridine-7,14-dione;ethane
CID 90939428
bis(9H-carbazole);ethane
CID 145072085
9H-carbazole;ethane
CID 91098062
5,12-dihydroquinolino[2,3-b]acridine-7,14-dione;ethane;methanesulfonate;methylsulfonylmethane;yttrium
CID 160914916
9H-carbazole
CID 66668984
bromomethane;9H-carbazole
CID 67594562
9H-carbazole;copper
CID 159878189
bis(9H-carbazole);platinum(2+)
CID 175826437
bis(9H-carbazole);propane
CID 90987002
6,13-diazatetracyclo[12.4.0.02,5.07,12]octadeca-1(18),2(5),7,9,11,14,16-heptaene-3,4-dione
CID 51038700
7,14-dioxo-5,12-dihydroquinolino[2,3-b]acridine-3-carboxylic acid
CID 18344486

Frequently Asked Questions

What is the IUPAC name of 10H-acridin-9-one;ethane?
The IUPAC name of 10H-acridin-9-one;ethane (CID 91525380) is 10H-acridin-9-one;ethane.
What is the SMILES notation for 10H-acridin-9-one;ethane?
The canonical SMILES for 10H-acridin-9-one;ethane is CC.CC.O=c1c2ccccc2[nH]c2ccccc12.
What is the InChIKey of 10H-acridin-9-one;ethane?
The InChIKey is UXQZJHKBZSAMJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9NO.2C2H6/c15-13-9-5-1-3-7-11(9)14-12-8-4-2-6-10(12)13;2*1-2/h1-8H,(H,14,15);2*1-2H3.
What are the key properties of 10H-acridin-9-one;ethane?
10H-acridin-9-one;ethane has a molecular weight of 255.36 g/mol, XLogP of 4.73, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10H-acridin-9-one;ethane is sourced from PubChem (CID 91525380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).