2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid

C12H11N3O3 — CID 166372467

IUPAC2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid
SMILESCN(CC(=O)O)C(=O)c1nccc2ncccc12
InChIInChI=1S/C12H11N3O3/c1-15(7-10(16)17)12(18)11-8-3-2-5-13-9(8)4-6-14-11/h2-6H,7H2,1H3,(H,16,17)
InChIKeyZVEPACMZCGQNSG-UHFFFAOYSA-N
MW245.24 g/mol
LogP0.79
Rot. Bonds3

About 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid

2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid (PubChem CID 166372467) has the molecular formula C12H11N3O3 and a molecular weight of 245.24 g/mol. Its IUPAC name is 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid
PubChem CID166372467
Molecular FormulaC12H11N3O3
Molecular Weight245.24 g/mol
Exact Mass245.08
IUPAC Name2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid
SMILESCN(CC(=O)O)C(=O)c1nccc2ncccc12
InChIInChI=1S/C12H11N3O3/c1-15(7-10(16)17)12(18)11-8-3-2-5-13-9(8)4-6-14-11/h2-6H,7H2,1H3,(H,16,17)
InChIKeyZVEPACMZCGQNSG-UHFFFAOYSA-N
XLogP0.79
TPSA83.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.24
LogP ≤ 50.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(3-aminopyridine-2-carbonyl)-methylamino]acetic acid
CID 112704117
1-(1,6-naphthyridin-5-yl)ethanone
CID 130047665
2-[(3-hydroxypyridine-2-carbonyl)-methylamino]acetic acid;methyl 2-[(3-hydroxypyridine-2-carbonyl)-methylamino]acetate
CID 159109262
2-[methyl(quinoxaline-5-carbonyl)amino]acetic acid
CID 104614064
2-[methyl-(4-pyridin-2-ylbenzoyl)amino]acetic acid
CID 110464860
2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]pyridine-3-carboxylic acid
CID 63615578
2-[methyl-(2-pyrrolidin-1-ylpyridine-3-carbonyl)amino]acetic acid
CID 119346290
2-[(2-methoxy-2-oxoethyl)-methylcarbamoyl]pyridine-3-carboxylic acid
CID 63614269
2-[methyl-(5-nitroquinolin-6-yl)amino]acetic acid
CID 43809826
2-[ethyl(quinoline-6-carbonyl)amino]acetic acid
CID 62849704
2-[methyl-[2-(2,2,2-trifluoroethoxy)pyridine-3-carbonyl]amino]acetic acid
CID 99697580
N-(2-aminopropyl)-N-methylisoquinoline-1-carboxamide
CID 63755212

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid?
The IUPAC name of 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid (CID 166372467) is 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid.
What is the SMILES notation for 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid?
The canonical SMILES for 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid is CN(CC(=O)O)C(=O)c1nccc2ncccc12.
What is the InChIKey of 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid?
The InChIKey is ZVEPACMZCGQNSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O3/c1-15(7-10(16)17)12(18)11-8-3-2-5-13-9(8)4-6-14-11/h2-6H,7H2,1H3,(H,16,17).
What are the key properties of 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid?
2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid has a molecular weight of 245.24 g/mol, XLogP of 0.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(1,6-naphthyridine-5-carbonyl)amino]acetic acid is sourced from PubChem (CID 166372467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).