2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide

C13H14N2O2 — CID 947985

IUPAC2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide
SMILESCc1cccc2c(=O)cc(C)n(CC(N)=O)c12
InChIInChI=1S/C13H14N2O2/c1-8-4-3-5-10-11(16)6-9(2)15(13(8)10)7-12(14)17/h3-6H,7H2,1-2H3,(H2,14,17)
InChIKeyVVOXFACSOCRHNP-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.10
Rot. Bonds2

About 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide

2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide (PubChem CID 947985) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound Name2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide
PubChem CID947985
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide
SMILESCc1cccc2c(=O)cc(C)n(CC(N)=O)c12
InChIInChI=1S/C13H14N2O2/c1-8-4-3-5-10-11(16)6-9(2)15(13(8)10)7-12(14)17/h3-6H,7H2,1-2H3,(H2,14,17)
InChIKeyVVOXFACSOCRHNP-UHFFFAOYSA-N
XLogP1.10
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-Methyl-4-quinolone
CID 6748
2-Methylquinolin-4-ol
CID 69089
3-Benzyl-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione
CID 15649435
8-Methyl-2-(trifluoromethyl)-4-quinolinol
CID 2775089
(S)-N-(2-benzoylphenyl)-1-benzylpyrrolidine-2-carboxamide
CID 2817619
4-methyl-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-2,5-dione
CID 3725575
2,3-Dimethylquinolin-4-OL
CID 237396
Cyclopeptine
CID 179574
11H-Cyclohepta(b)quinolin-11-one, 5,6,7,8,9,10-hexahydro-
CID 21282
N-(2-Acetylphenyl)acetamide
CID 21306
4-Hydroxy-6-methylquinoline
CID 256080
4-Hydroxy-2,6-dimethylquinoline
CID 284004

Frequently Asked Questions

What is the IUPAC name of 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide?
The IUPAC name of 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide (CID 947985) is 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide?
The canonical SMILES for 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide is Cc1cccc2c(=O)cc(C)n(CC(N)=O)c12.
What is the InChIKey of 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide?
The InChIKey is VVOXFACSOCRHNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-8-4-3-5-10-11(16)6-9(2)15(13(8)10)7-12(14)17/h3-6H,7H2,1-2H3,(H2,14,17).
What are the key properties of 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide?
2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide has a molecular weight of 230.27 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,8-dimethyl-4-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 947985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).