10,10a-dihydro-1H-acridin-2-one

C13H11NO — CID 22375080

IUPAC10,10a-dihydro-1H-acridin-2-one
SMILESO=C1C=CC2=C(C=C3C=CC=CC3N2)C1
InChIInChI=1S/C13H11NO/c15-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)14-13/h1-7,12,14H,8H2
InChIKeyKRHWHLGKENTNCR-UHFFFAOYSA-N
MW197.24 g/mol
LogP1.79
Rot. Bonds

About 10,10a-dihydro-1H-acridin-2-one

10,10a-dihydro-1H-acridin-2-one (PubChem CID 22375080) has the molecular formula C13H11NO and a molecular weight of 197.24 g/mol. Its IUPAC name is 10,10a-dihydro-1H-acridin-2-one.

Molecular Properties

Compound Name10,10a-dihydro-1H-acridin-2-one
PubChem CID22375080
Molecular FormulaC13H11NO
Molecular Weight197.24 g/mol
Exact Mass197.08
IUPAC Name10,10a-dihydro-1H-acridin-2-one
SMILESO=C1C=CC2=C(C=C3C=CC=CC3N2)C1
InChIInChI=1S/C13H11NO/c15-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)14-13/h1-7,12,14H,8H2
InChIKeyKRHWHLGKENTNCR-UHFFFAOYSA-N
XLogP1.79
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 10,10a-dihydro-1H-acridin-2-one?
The IUPAC name of 10,10a-dihydro-1H-acridin-2-one (CID 22375080) is 10,10a-dihydro-1H-acridin-2-one.
What is the SMILES notation for 10,10a-dihydro-1H-acridin-2-one?
The canonical SMILES for 10,10a-dihydro-1H-acridin-2-one is O=C1C=CC2=C(C=C3C=CC=CC3N2)C1.
What is the InChIKey of 10,10a-dihydro-1H-acridin-2-one?
The InChIKey is KRHWHLGKENTNCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO/c15-11-5-6-13-10(8-11)7-9-3-1-2-4-12(9)14-13/h1-7,12,14H,8H2.
What are the key properties of 10,10a-dihydro-1H-acridin-2-one?
10,10a-dihydro-1H-acridin-2-one has a molecular weight of 197.24 g/mol, XLogP of 1.79, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10a-dihydro-1H-acridin-2-one is sourced from PubChem (CID 22375080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).