6-Amino-2,2-dimethyl-2H-pyrido[3,2-B][1,4]oxazin-3(4H)-one

C₉H₁₁N₃O₂CAS 1002726-62-6193.21 g/mol

Open in Covalent MOL file

Amide Ether Lactam Primary amine

Properties

Molecular formula: C₉H₁₁N₃O₂
Molar mass: 193.21 g/mol
Exact mass: 193.0851 Da
logP: 0.77Crippen estimate
Polar surface area: 77.2 Å²
H-bond donors / acceptors: 2 / 4
Rotatable bonds: 0

Hazards

H411 Toxic to aquatic life with long lasting effects100% of notifiers

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P273, P391, P501

Identifiers

CAS number

1002726-62-6

SMILES

CC1(C(=O)NC2=C(O1)C=CC(=N2)N)C

InChIKey

HSYOWUOUDXDSMC-UHFFFAOYSA-N

InChI

InChI=1S/C9H11N3O2/c1-9(2)8(13)12-7-5(14-9)3-4-6(10)11-7/h3-4H,1-2H3,(H3,10,11,12,13)

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Names and synonyms

1 names

2H-Pyrido(3,2-b)-1,4-oxazin-3(4H)-one, 6-amino-2,2-dimethyl-

Work with 6-Amino-2,2-dimethyl-2H-pyrido[3,2-B][1,4]oxazin-3(4H)-one

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

R406841290-81-134 % similar N-(6-Aminopyridin-2-yl)acetamide1075-62-334 % similar N-(3-Iodopyridin-2-yl)-2,2-dimethylpropanamide113975-31-834 % similar N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide86847-64-533 % similar 6-Aminopicolinic acid methyl ester36052-26-331 % similar 2,2-Dimethyl-N-pyridin-2-yl-propionamide86847-59-831 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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