6-methoxy-4aH-quinolin-2-one

C10H9NO2 — CID 71650454

IUPAC6-methoxy-4aH-quinolin-2-one
SMILESCOC1=CC2C=CC(=O)N=C2C=C1
InChIInChI=1S/C10H9NO2/c1-13-8-3-4-9-7(6-8)2-5-10(12)11-9/h2-7H,1H3
InChIKeyDQJHVDBHUBBJTC-UHFFFAOYSA-N
MW175.19 g/mol
LogP1.24
Rot. Bonds1

About 6-methoxy-4aH-quinolin-2-one

6-methoxy-4aH-quinolin-2-one (PubChem CID 71650454) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is 6-methoxy-4aH-quinolin-2-one.

Molecular Properties

Compound Name6-methoxy-4aH-quinolin-2-one
PubChem CID71650454
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name6-methoxy-4aH-quinolin-2-one
SMILESCOC1=CC2C=CC(=O)N=C2C=C1
InChIInChI=1S/C10H9NO2/c1-13-8-3-4-9-7(6-8)2-5-10(12)11-9/h2-7H,1H3
InChIKeyDQJHVDBHUBBJTC-UHFFFAOYSA-N
XLogP1.24
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Furo[3,2-g]quinolin-7-one
CID 129869574
6-Methoxybenzazepin-2-one
CID 20137812
5-Methoxyindol-2-one
CID 23212395
5-Ethoxyindol-2-one
CID 23212399
6-Methoxyindol-2-one
CID 46739860
8-Methoxy-1-benzazepin-2-one
CID 57417925
Pyrano[3,2-g]quinolin-8-one
CID 91526879
2-methyl-2H-furo[2,3-f]quinolin-7-one
CID 139944555
4-Methoxyindol-2-one
CID 152312539
Magnesium;indol-2-one;methoxybenzene;bromide
CID 159748140
7-(4-bromobutoxy)-4aH-quinolin-2-one
CID 45038437
7-(3-bromopropoxy)-4aH-quinolin-2-one
CID 45038463

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4aH-quinolin-2-one?
The IUPAC name of 6-methoxy-4aH-quinolin-2-one (CID 71650454) is 6-methoxy-4aH-quinolin-2-one.
What is the SMILES notation for 6-methoxy-4aH-quinolin-2-one?
The canonical SMILES for 6-methoxy-4aH-quinolin-2-one is COC1=CC2C=CC(=O)N=C2C=C1.
What is the InChIKey of 6-methoxy-4aH-quinolin-2-one?
The InChIKey is DQJHVDBHUBBJTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2/c1-13-8-3-4-9-7(6-8)2-5-10(12)11-9/h2-7H,1H3.
What are the key properties of 6-methoxy-4aH-quinolin-2-one?
6-methoxy-4aH-quinolin-2-one has a molecular weight of 175.19 g/mol, XLogP of 1.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4aH-quinolin-2-one is sourced from PubChem (CID 71650454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).