2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide

C11H15N3O — CID 115318363

IUPAC2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide
SMILESCC1CNc2ccccc2N1CC(N)=O
InChIInChI=1S/C11H15N3O/c1-8-6-13-9-4-2-3-5-10(9)14(8)7-11(12)15/h2-5,8,13H,6-7H2,1H3,(H2,12,15)
InChIKeyQCMWMZGZGONPDP-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.79
Rot. Bonds2

About 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide

2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide (PubChem CID 115318363) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide.

Molecular Properties

Compound Name2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide
PubChem CID115318363
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide
SMILESCC1CNc2ccccc2N1CC(N)=O
InChIInChI=1S/C11H15N3O/c1-8-6-13-9-4-2-3-5-10(9)14(8)7-11(12)15/h2-5,8,13H,6-7H2,1H3,(H2,12,15)
InChIKeyQCMWMZGZGONPDP-UHFFFAOYSA-N
XLogP0.79
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 22200023
4-benzyl-3-methyl-2,3-dihydro-1H-quinoxaline
CID 75481796
3-[(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)methyl]pentan-3-ol
CID 114496646
4-(cyclopentylmethyl)-3-methyl-2,3-dihydro-1H-quinoxaline
CID 115318348
1-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)ethanone;hydrochloride
CID 154574825
2-[2-(methylamino)-2,3-dihydrobenzimidazol-1-yl]acetamide
CID 86341354
4-[(E)-3-chloroprop-2-enyl]-3-methyl-2,3-dihydro-1H-quinoxaline
CID 115318552
4-[2-(2-methoxyethoxy)ethyl]-3-methyl-2,3-dihydro-1H-quinoxaline
CID 115318465
1-methyl-5-[(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)methyl]pyrazole-4-carboxylic acid
CID 116632480
1-(2-amino-2-oxoethyl)-2-methyl-3,4-dihydro-2H-quinoline-4-carboxamide
CID 167920926
4-[(3,5-difluorophenyl)methyl]-3-methyl-2,3-dihydro-1H-quinoxaline
CID 105404987
4-[(2-chlorophenyl)methyl]-3-methyl-2,3-dihydro-1H-quinoxaline
CID 115318440

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide?
The IUPAC name of 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide (CID 115318363) is 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide.
What is the SMILES notation for 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide?
The canonical SMILES for 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide is CC1CNc2ccccc2N1CC(N)=O.
What is the InChIKey of 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide?
The InChIKey is QCMWMZGZGONPDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8-6-13-9-4-2-3-5-10(9)14(8)7-11(12)15/h2-5,8,13H,6-7H2,1H3,(H2,12,15).
What are the key properties of 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide?
2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide has a molecular weight of 205.26 g/mol, XLogP of 0.79, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-3,4-dihydro-2H-quinoxalin-1-yl)acetamide is sourced from PubChem (CID 115318363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).