9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one

C14H14N2O2 — CID 15043979

IUPAC9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one
SMILESCOc1ccc2nc3c(c(N)c2c1)C(=O)CCC3
InChIInChI=1S/C14H14N2O2/c1-18-8-5-6-10-9(7-8)14(15)13-11(16-10)3-2-4-12(13)17/h5-7H,2-4H2,1H3,(H2,15,16)
InChIKeyUMCAERASQBVGHC-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.34
Rot. Bonds1

About 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one

9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one (PubChem CID 15043979) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one.

Molecular Properties

Compound Name9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one
PubChem CID15043979
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one
SMILESCOc1ccc2nc3c(c(N)c2c1)C(=O)CCC3
InChIInChI=1S/C14H14N2O2/c1-18-8-5-6-10-9(7-8)14(15)13-11(16-10)3-2-4-12(13)17/h5-7H,2-4H2,1H3,(H2,15,16)
InChIKeyUMCAERASQBVGHC-UHFFFAOYSA-N
XLogP2.34
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one?
The IUPAC name of 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one (CID 15043979) is 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one.
What is the SMILES notation for 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one?
The canonical SMILES for 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one is COc1ccc2nc3c(c(N)c2c1)C(=O)CCC3.
What is the InChIKey of 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one?
The InChIKey is UMCAERASQBVGHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-18-8-5-6-10-9(7-8)14(15)13-11(16-10)3-2-4-12(13)17/h5-7H,2-4H2,1H3,(H2,15,16).
What are the key properties of 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one?
9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one has a molecular weight of 242.28 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-amino-7-methoxy-3,4-dihydro-2H-acridin-1-one is sourced from PubChem (CID 15043979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).