3,6-dimethyl-1H-quinoxalin-2-one

C10H10N2O — CID 11636895

IUPAC3,6-dimethyl-1H-quinoxalin-2-one
SMILESCc1ccc2[nH]c(=O)c(C)nc2c1
InChIInChI=1S/C10H10N2O/c1-6-3-4-8-9(5-6)11-7(2)10(13)12-8/h3-5H,1-2H3,(H,12,13)
InChIKeyGYAWPCDVXKFLSF-UHFFFAOYSA-N
MW174.20 g/mol
LogP1.54
Rot. Bonds

About 3,6-dimethyl-1H-quinoxalin-2-one

3,6-dimethyl-1H-quinoxalin-2-one (PubChem CID 11636895) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 3,6-dimethyl-1H-quinoxalin-2-one.

Molecular Properties

Compound Name3,6-dimethyl-1H-quinoxalin-2-one
PubChem CID11636895
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name3,6-dimethyl-1H-quinoxalin-2-one
SMILESCc1ccc2[nH]c(=O)c(C)nc2c1
InChIInChI=1S/C10H10N2O/c1-6-3-4-8-9(5-6)11-7(2)10(13)12-8/h3-5H,1-2H3,(H,12,13)
InChIKeyGYAWPCDVXKFLSF-UHFFFAOYSA-N
XLogP1.54
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-Methylphenyl)acetamide
CID 10843
4-Methylacetanilide
CID 7684
3-Methylquinoxalin-2-ol
CID 26384
1,3-Dihydro-4-phenyl-2H-1,5-benzodiazepin-2-one
CID 177746
3-Phenylquinoxalin-2(1H)-one
CID 346902
3-Ethylquinoxalin-2(1H)-one
CID 599963
2-Benzyl-3-hydroxyquinoxaline
CID 659725
1,4-Dihydro-6-methylquinoxaline-2,3-dione
CID 73225
6,7-Dimethyl-2,3-quinoxalinediol
CID 247670
7,8-Dimethyl-4-phenyl-1,3-dihydro-2H-1,5-benzodiazepin-2-one
CID 268099
4-[(E)-2-phenylethenyl]-1,3-dihydro-1,5-benzodiazepin-2-one
CID 754807
3-(2-Phenylethyl)-1H-quinoxalin-2-one
CID 4884003

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethyl-1H-quinoxalin-2-one?
The IUPAC name of 3,6-dimethyl-1H-quinoxalin-2-one (CID 11636895) is 3,6-dimethyl-1H-quinoxalin-2-one.
What is the SMILES notation for 3,6-dimethyl-1H-quinoxalin-2-one?
The canonical SMILES for 3,6-dimethyl-1H-quinoxalin-2-one is Cc1ccc2[nH]c(=O)c(C)nc2c1.
What is the InChIKey of 3,6-dimethyl-1H-quinoxalin-2-one?
The InChIKey is GYAWPCDVXKFLSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-6-3-4-8-9(5-6)11-7(2)10(13)12-8/h3-5H,1-2H3,(H,12,13).
What are the key properties of 3,6-dimethyl-1H-quinoxalin-2-one?
3,6-dimethyl-1H-quinoxalin-2-one has a molecular weight of 174.20 g/mol, XLogP of 1.54, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethyl-1H-quinoxalin-2-one is sourced from PubChem (CID 11636895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).