N-(2,3,7-trimethylquinoxalin-6-yl)acetamide

C13H15N3O — CID 20559628

IUPACN-(2,3,7-trimethylquinoxalin-6-yl)acetamide
SMILESCC(=O)Nc1cc2nc(C)c(C)nc2cc1C
InChIInChI=1S/C13H15N3O/c1-7-5-12-13(6-11(7)16-10(4)17)15-9(3)8(2)14-12/h5-6H,1-4H3,(H,16,17)
InChIKeyGXVFMKYIJPLGHA-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.51
Rot. Bonds1

About N-(2,3,7-trimethylquinoxalin-6-yl)acetamide

N-(2,3,7-trimethylquinoxalin-6-yl)acetamide (PubChem CID 20559628) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is N-(2,3,7-trimethylquinoxalin-6-yl)acetamide.

Molecular Properties

Compound NameN-(2,3,7-trimethylquinoxalin-6-yl)acetamide
PubChem CID20559628
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC NameN-(2,3,7-trimethylquinoxalin-6-yl)acetamide
SMILESCC(=O)Nc1cc2nc(C)c(C)nc2cc1C
InChIInChI=1S/C13H15N3O/c1-7-5-12-13(6-11(7)16-10(4)17)15-9(3)8(2)14-12/h5-6H,1-4H3,(H,16,17)
InChIKeyGXVFMKYIJPLGHA-UHFFFAOYSA-N
XLogP2.51
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3,4,5-tetramethylphenyl)acetamide
CID 54490294
1-(2,4-dimethylphenyl)-3-(2,3-dimethylquinoxalin-6-yl)urea
CID 108885528
(4-acetamido-2,5-dimethylphenyl) thiocyanate
CID 12771494
N-(4-cyano-2,5-dimethylphenyl)acetamide
CID 10910295
N-(3-acetamido-4-methoxyphenyl)-2,3-dimethylquinoxaline-6-carboxamide
CID 46543736
N-(2,4,6-trimethyl-3-pyridinyl)acetamide
CID 586045
CID 164856832
CID 164856832
N-(5-bromo-4-methoxy-2-methylphenyl)acetamide
CID 66766852
ethane;2-methylprop-1-ene;N-(4-methylthiophen-3-yl)acetamide
CID 143490448
N-[2,5-dimethyl-4-(oxiran-2-yl)phenyl]acetamide
CID 18316769
(E)-3-(4-acetamido-3-methylphenyl)prop-2-enoic acid
CID 18321824
N-(2-methyl-5-pyridin-4-ylphenyl)acetamide
CID 71934327

Frequently Asked Questions

What is the IUPAC name of N-(2,3,7-trimethylquinoxalin-6-yl)acetamide?
The IUPAC name of N-(2,3,7-trimethylquinoxalin-6-yl)acetamide (CID 20559628) is N-(2,3,7-trimethylquinoxalin-6-yl)acetamide.
What is the SMILES notation for N-(2,3,7-trimethylquinoxalin-6-yl)acetamide?
The canonical SMILES for N-(2,3,7-trimethylquinoxalin-6-yl)acetamide is CC(=O)Nc1cc2nc(C)c(C)nc2cc1C.
What is the InChIKey of N-(2,3,7-trimethylquinoxalin-6-yl)acetamide?
The InChIKey is GXVFMKYIJPLGHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-7-5-12-13(6-11(7)16-10(4)17)15-9(3)8(2)14-12/h5-6H,1-4H3,(H,16,17).
What are the key properties of N-(2,3,7-trimethylquinoxalin-6-yl)acetamide?
N-(2,3,7-trimethylquinoxalin-6-yl)acetamide has a molecular weight of 229.28 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3,7-trimethylquinoxalin-6-yl)acetamide is sourced from PubChem (CID 20559628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).