methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate

C13H15N3O2 — CID 62375684

IUPACmethyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate
SMILESCOC(=O)CN(C)c1nc2ccccc2nc1C
InChIInChI=1S/C13H15N3O2/c1-9-13(16(2)8-12(17)18-3)15-11-7-5-4-6-10(11)14-9/h4-7H,8H2,1-3H3
InChIKeyIJUNLWRPUJXTRW-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.55
Rot. Bonds3

About methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate

methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate (PubChem CID 62375684) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate
PubChem CID62375684
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Namemethyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate
SMILESCOC(=O)CN(C)c1nc2ccccc2nc1C
InChIInChI=1S/C13H15N3O2/c1-9-13(16(2)8-12(17)18-3)15-11-7-5-4-6-10(11)14-9/h4-7H,8H2,1-3H3
InChIKeyIJUNLWRPUJXTRW-UHFFFAOYSA-N
XLogP1.55
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N,3-dimethyl-N-(2-methylprop-2-enyl)quinoxalin-2-amine
CID 133439230
4-[methyl-(3-methylquinoxalin-2-yl)amino]butanoic acid
CID 62374872
N-[3-[methyl-(3-methylquinoxalin-2-yl)amino]propyl]acetamide
CID 133313683
1-methoxy-3-[methyl-(3-methylquinoxalin-2-yl)amino]propan-2-ol
CID 62375523
ethyl 2-[(3-methylquinoxalin-2-yl)-propan-2-ylamino]acetate
CID 62375691
methyl 2-[1,2,4-benzotriazin-3-yl-(2-methoxy-2-oxoethyl)amino]acetate
CID 103204961
N-ethyl-2-[ethyl-(3-methylquinoxalin-2-yl)amino]acetamide
CID 133382747
2-[tert-butyl-(3-methylquinoxalin-2-yl)amino]acetic acid
CID 79269083
methyl 2-[methyl(pyrimidin-2-yl)amino]acetate
CID 60660073
ethyl 2-[(2-methoxy-2-oxoethyl)-methylamino]pyridine-3-carboxylate
CID 55037918
methyl 2-(2-bromo-N-methylanilino)acetate
CID 115232844
ethyl 2-[methyl(quinazolin-4-yl)amino]acetate
CID 62006339

Frequently Asked Questions

What is the IUPAC name of methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate?
The IUPAC name of methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate (CID 62375684) is methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate.
What is the SMILES notation for methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate?
The canonical SMILES for methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate is COC(=O)CN(C)c1nc2ccccc2nc1C.
What is the InChIKey of methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate?
The InChIKey is IJUNLWRPUJXTRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9-13(16(2)8-12(17)18-3)15-11-7-5-4-6-10(11)14-9/h4-7H,8H2,1-3H3.
What are the key properties of methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate?
methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate has a molecular weight of 245.28 g/mol, XLogP of 1.55, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[methyl-(3-methylquinoxalin-2-yl)amino]acetate is sourced from PubChem (CID 62375684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).