1-methyl-7,8-dihydro-6H-quinoline-2,5-dione

C10H11NO2 — CID 10442242

IUPAC1-methyl-7,8-dihydro-6H-quinoline-2,5-dione
SMILESCn1c2c(ccc1=O)C(=O)CCC2
InChIInChI=1S/C10H11NO2/c1-11-8-3-2-4-9(12)7(8)5-6-10(11)13/h5-6H,2-4H2,1H3
InChIKeyGKMANJNJOGJCNJ-UHFFFAOYSA-N
MW177.20 g/mol
LogP0.90
Rot. Bonds

About 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione

1-methyl-7,8-dihydro-6H-quinoline-2,5-dione (PubChem CID 10442242) has the molecular formula C10H11NO2 and a molecular weight of 177.20 g/mol. Its IUPAC name is 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione.

Molecular Properties

Compound Name1-methyl-7,8-dihydro-6H-quinoline-2,5-dione
PubChem CID10442242
Molecular FormulaC10H11NO2
Molecular Weight177.20 g/mol
Exact Mass177.08
IUPAC Name1-methyl-7,8-dihydro-6H-quinoline-2,5-dione
SMILESCn1c2c(ccc1=O)C(=O)CCC2
InChIInChI=1S/C10H11NO2/c1-11-8-3-2-4-9(12)7(8)5-6-10(11)13/h5-6H,2-4H2,1H3
InChIKeyGKMANJNJOGJCNJ-UHFFFAOYSA-N
XLogP0.90
TPSA39.07 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.20
LogP ≤ 50.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Hydroxy-7,8-dihydro-5(6H)-quinolinone
CID 267450
Quinone, 12
CID 14929519
2(1H)-Pyridinone, 1-(3-oxo-1-cyclohexen-1-yl)-
CID 339627
N-ethyl-5-oxo-5,6,7,8-tetrahydrocarbostyril
CID 12229996
1-Butyl-5,6,7,8-tetrahydro-1h-quinolin-2-one
CID 13169241
1-methyl-4-(trifluoromethyl)-7,8-dihydro-6H-quinoline-2,5-dione
CID 3647550
1-(trifluoromethyl)-7,8-dihydro-6H-quinoline-2,5-dione
CID 156504687
1-Isopropyl-7,8-dihydroquinoline-2,5(1H,6H)-dione
CID 10104400
1-Butyl-3-ethyl-5,6,7,8-tetrahydroquinolin-2-one
CID 13169244
1-(2,2-difluoroethyl)-7,8-dihydro-6H-quinoline-2,5-dione
CID 81104270
1-(2,2,2-trifluoroethyl)-7,8-dihydro-6H-quinoline-2,5-dione
CID 81104411
1-(3,3,3-trifluoropropyl)-7,8-dihydro-6H-quinoline-2,5-dione
CID 81104970

Frequently Asked Questions

What is the IUPAC name of 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione?
The IUPAC name of 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione (CID 10442242) is 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione.
What is the SMILES notation for 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione?
The canonical SMILES for 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione is Cn1c2c(ccc1=O)C(=O)CCC2.
What is the InChIKey of 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione?
The InChIKey is GKMANJNJOGJCNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2/c1-11-8-3-2-4-9(12)7(8)5-6-10(11)13/h5-6H,2-4H2,1H3.
What are the key properties of 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione?
1-methyl-7,8-dihydro-6H-quinoline-2,5-dione has a molecular weight of 177.20 g/mol, XLogP of 0.90, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-7,8-dihydro-6H-quinoline-2,5-dione is sourced from PubChem (CID 10442242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).