8-methoxy-2,3-dihydro-1H-quinolin-4-one

C10H11NO2 — CID 23008901

IUPAC8-methoxy-2,3-dihydro-1H-quinolin-4-one
SMILESCOc1cccc2c1NCCC2=O
InChIInChI=1S/C10H11NO2/c1-13-9-4-2-3-7-8(12)5-6-11-10(7)9/h2-4,11H,5-6H2,1H3
InChIKeyIJWZWYMJURKOBU-UHFFFAOYSA-N
MW177.20 g/mol
LogP1.69
Rot. Bonds1

About 8-methoxy-2,3-dihydro-1H-quinolin-4-one

8-methoxy-2,3-dihydro-1H-quinolin-4-one (PubChem CID 23008901) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 8-methoxy-2,3-dihydro-1H-quinolin-4-one.

Molecular Properties

Compound Name8-methoxy-2,3-dihydro-1H-quinolin-4-one
PubChem CID23008901
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name8-methoxy-2,3-dihydro-1H-quinolin-4-one
SMILESCOc1cccc2c1NCCC2=O
InChIInChI=1S/C10H11NO2/c1-13-9-4-2-3-7-8(12)5-6-11-10(7)9/h2-4,11H,5-6H2,1H3
InChIKeyIJWZWYMJURKOBU-UHFFFAOYSA-N
XLogP1.69
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2,3-dihydro-1H-quinolin-4-one?
The IUPAC name of 8-methoxy-2,3-dihydro-1H-quinolin-4-one (CID 23008901) is 8-methoxy-2,3-dihydro-1H-quinolin-4-one.
What is the SMILES notation for 8-methoxy-2,3-dihydro-1H-quinolin-4-one?
The canonical SMILES for 8-methoxy-2,3-dihydro-1H-quinolin-4-one is COc1cccc2c1NCCC2=O.
What is the InChIKey of 8-methoxy-2,3-dihydro-1H-quinolin-4-one?
The InChIKey is IJWZWYMJURKOBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-13-9-4-2-3-7-8(12)5-6-11-10(7)9/h2-4,11H,5-6H2,1H3.
What are the key properties of 8-methoxy-2,3-dihydro-1H-quinolin-4-one?
8-methoxy-2,3-dihydro-1H-quinolin-4-one has a molecular weight of 177.20 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2,3-dihydro-1H-quinolin-4-one is sourced from PubChem (CID 23008901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).