6-Fluorogramine

C₁₁H₁₃FN₂CAS 343-93-1192.24 g/mol

Open in Covalent MOL file

Aryl halide Tertiary amine

Properties

Molecular formula: C₁₁H₁₃FN₂
Molar mass: 192.24 g/mol
Exact mass: 192.1063 Da
logP: 2.37Crippen estimate
Polar surface area: 19.0 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

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

Precautionary statements

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

Identifiers

CAS number

343-93-1

SMILES

CN(C)CC1=CNC2=C1C=CC(=C2)F

InChIKey

PAAOUYLDLVHKKR-UHFFFAOYSA-N

InChI

InChI=1S/C11H13FN2/c1-14(2)7-8-6-13-11-5-9(12)3-4-10(8)11/h3-6,13H,7H2,1-2H3

Weigh it out

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Work with 6-Fluorogramine

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

N,N-Dimethyl-1-(6-methyl-1H-indol-3-yl)methanamine35998-04-066 % similar Gramine87-52-559 % similar 6-Fluorotryptamine575-85-959 % similar 6-Fluoro-1H-indole-3-acetonitrile2341-25-556 % similar 6-Fluorotryptamine hydrochloride55206-24-155 % similar 6-Fluoroindole-3-acetic acid443-75-452 % similar 5-Methoxy-N,N-dimethyl-1H-indole-3-methanamine16620-52-351 % similar 6-Fluorotryptophan7730-20-346 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

5-Fluoro-N,N-dimethyl-1H-indole-3-methanamine343-90-8

Elsewhere

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