2,2-Dimethyl-2H-pyrido[3,2-b]-1,4-oxazin-3(4H)-one

C₉H₁₀N₂O₂CAS 20348-21-4178.19 g/mol

Open in Covalent MOL file

Ether

Properties

Molecular formula: C₉H₁₀N₂O₂
Molar mass: 178.19 g/mol
Exact mass: 178.0742 Da
logP: 1.84Crippen estimate
Polar surface area: 54.7 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation50% of notifiers
H319 Causes serious eye irritation50% of notifiers
H335 May cause respiratory irritation50% of notifiers

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

20348-21-4

SMILES

CC1(C)Oc2cccnc2N=C1O

InChIKey

DMLNXUUGRSBBBR-UHFFFAOYSA-N

InChI

InChI=1S/C9H10N2O2/c1-9(2)8(12)11-7-6(13-9)4-3-5-10-7/h3-5H,1-2H3,(H,10,11,12)

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Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names

2H-Pyrido[3,2-b]-1,4-oxazin-3(4H)-one, 2,2-dimethyl-
2,2-Dimethyl-4H-pyrido[3,2-b][1,4]oxazin-3-one

Work with 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

2H-Pyrido(3,2-b)-1,4-oxazin-3(4H)-one20348-09-845 % similar 1,3-Dihydro-2H-pyrrolo(2,3-b)pyridin-2-one5654-97-739 % similar 1,1-Dimethylethyl N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-pyridinyl]carbamate1072944-99-036 % similar 3-Methoxy-2(1H)-pyridinone20928-63-633 % similar 6-[[5-Fluoro-2-[(3,4,5-trimethoxyphenyl)amino]-4-pyrimidinyl]amino]-2,2-dimethyl-2H-pyrido[3,2-b]-1,4-oxazin-3(4H)-one841290-80-033 % similar 3-(Trifluoromethyl)pyridine-2-carboxylic acid87407-12-332 % similar Fibric acid943-45-332 % similar 2,3-Dimethoxypyridine52605-97-732 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-4,5-dimethoxybenzonitrile26961-27-3 1-Ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-3-pyridinecarbonitrile28141-13-1 7-Nitro-1,2,3,4-tetrahydroquinoline30450-62-5 1,2,3,4-Tetrahydro-7-nitroisoquinoline42923-79-5 5,6-Dimethoxybenzimidazole72721-02-9

Elsewhere

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