1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one dihydrochloride

HCID 22293181CAS 781649-84-1

Grundinformationen

Standard-SMILES
Cl.Cl.O=c1[nH]c2ncccc2n1C1CCNCC1
InChIKey
OHUCGNJZMRINKX-UHFFFAOYSA-N
Summenformel
C11H16Cl2N4O
Durchschnittliche Molmasse
291,17 g/mol
Monoisotopische Masse
290,07011649

Überblick

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Namen und Bezeichner

Bevorzugter Name
1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one dihydrochloride
IUPAC
1-piperidin-4-yl-3H-imidazo[4,5-b]pyridin-2-one;dihydrochloride

Namen und Synonyme

1-(piperidin-4-yl)-1H,2H,3H-imidazo[4,5-b]pyridin-2-one dihydrochloride1-piperidin-4-yl-1,3-dihydroimidazo[4,5-b]pyridin-2-one dihydrochloride1-(piperidin-4-yl)-1H,2H,3H-imidazo(4,5-b)pyridin-2-one dihydrochloride1-Piperidin-4-yl-1,3-dihydroimidazo(4,5-b)pyridin-2-one dihydrochlorideRefChem:428316937-843-7781649-84-11-(Piperidin-4-yl)-1H-imidazo[4,5-b]pyridin-2(3H)-one dihydrochloride1-piperidin-4-yl-1,3-dihydro-imidazo[4,5-b]pyridin-2-one dihydrochlorideMFCD147051731-piperidin-4-yl-3H-imidazo[4,5-b]pyridin-2-one;dihydrochloride2-Oxo-1-(4-piperidinyl)-2,3-dihydro-1H-imidazo[4,5-b]pyridine dihydrochloride
Weitere Namen anzeigen
1-(Piperidin-4-yl)-1H-imidazo[4,5-b]pyridin-2(3H)-one (Hydrochloride)OHUCGNJZMRINKX-UHFFFAOYSA-N1,3-Dihydro-1-(4-piperidinyl)-2H-imidazo[4,5-b]pyridin-2-one DihydrochlorideRimegepant Impurity 2 DiHClSCHEMBL438908orb3143748CHEMBL3498426SCHEMBL30007314

Datenbank-Bezeichner

CAS
781649-84-1
PubChem CID
22293181
DTXSID
DTXSID80624480
ChEMBL
CHEMBL3498426
EC Number
937-843-7

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
57,3 Ų
H-Brücken-Donoren
4
H-Brücken-Akzeptoren
3
Frei drehbare Bindungen
1
Schwere Atome
18

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Zugehörige Reaktionen

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