N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide

C15H19N3O3 — CID 178090618

IUPACN-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide
SMILESCOc1cc(NC(=O)CC(C)C)c(OC)c2nccnc12
InChIInChI=1S/C15H19N3O3/c1-9(2)7-12(19)18-10-8-11(20-3)13-14(15(10)21-4)17-6-5-16-13/h5-6,8-9H,7H2,1-4H3,(H,18,19)
InChIKeyGBAYROUFNLZPTJ-UHFFFAOYSA-N
MW289.34 g/mol
LogP2.63
Rot. Bonds5

About N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide

N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide (PubChem CID 178090618) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide.

Molecular Properties

Compound NameN-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide
PubChem CID178090618
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC NameN-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide
SMILESCOc1cc(NC(=O)CC(C)C)c(OC)c2nccnc12
InChIInChI=1S/C15H19N3O3/c1-9(2)7-12(19)18-10-8-11(20-3)13-14(15(10)21-4)17-6-5-16-13/h5-6,8-9H,7H2,1-4H3,(H,18,19)
InChIKeyGBAYROUFNLZPTJ-UHFFFAOYSA-N
XLogP2.63
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5,8-dimethoxyquinoxalin-6-yl)-2-(dimethylamino)acetamide
CID 178179106
N-(8-methoxyquinolin-5-yl)-3-methylbutanamide
CID 26823099
N-(4-methoxy-3-pyridinyl)-3-methylbutanamide
CID 176872995
N-[2,5-dimethoxy-4-[(2-phenylacetyl)amino]phenyl]-3-methylbutanamide
CID 1428034
N-(5-bromo-2-methoxyphenyl)-3-methylbutanamide
CID 47317654
3,4,5-trimethoxy-N-[4-(3-methylbutanoylamino)phenyl]benzamide
CID 17193980
N-(4-chloro-2-methoxy-5-methylphenyl)-3-methylbutanamide
CID 9397630
3-methyl-1-(3,4,5-trimethoxyphenyl)butan-1-one
CID 93191215
N-(6-amino-5-methoxy-3-pyridinyl)-3-methylbutanamide
CID 165440833
N-[2-(4-chloro-2,5-dimethoxyanilino)-2-oxoethyl]-3-methylbutanamide
CID 113001550
N-(4-methoxy-2-methylpyrimidin-5-yl)-3-methylbutanamide
CID 176873389
N-(4-methoxypyrimidin-2-yl)-3-methylbutanamide
CID 130219531

Frequently Asked Questions

What is the IUPAC name of N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide?
The IUPAC name of N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide (CID 178090618) is N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide.
What is the SMILES notation for N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide?
The canonical SMILES for N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide is COc1cc(NC(=O)CC(C)C)c(OC)c2nccnc12.
What is the InChIKey of N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide?
The InChIKey is GBAYROUFNLZPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-9(2)7-12(19)18-10-8-11(20-3)13-14(15(10)21-4)17-6-5-16-13/h5-6,8-9H,7H2,1-4H3,(H,18,19).
What are the key properties of N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide?
N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide has a molecular weight of 289.34 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,8-dimethoxyquinoxalin-6-yl)-3-methylbutanamide is sourced from PubChem (CID 178090618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).