Imidazo(4,5-b)pyridine-6-carboxylic acid, 3-(2-diethylaminoethyl)-, methyl ester

HCID 76055

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Basic information

CAS: 2813-72-1
Standard SMILES: CCN(CC)CCn1cnc2cc(C(=O)OC)cnc21
InChIKey: MTRVCBHDVRYUTK-UHFFFAOYSA-N
Molecular formula: C14H20N4O2
Average molar mass: 276.33 g/mol
Monoisotopic mass: 276.15862589

Names & identifiers

Preferred name: Imidazo(4,5-b)pyridine-6-carboxylic acid, 3-(2-diethylaminoethyl)-, methyl ester
IUPAC: methyl 3-[2-(diethylamino)ethyl]imidazo[4,5-b]pyridine-6-carboxylate
English name: 3-[2-(Diethylamino)ethyl]-3H-imidazo[4,5-b]pyridine-6-carboxylic acid methyl ester
Molecular formula: C14H20N4O2
Molecular weight: 0

Names & synonyms

BRN 0818696Imidazo(4,5-b)pyridine-6-carboxylic acid, 3-(2-diethylaminoethyl)-, methyl ester2813-72-1DTXSID101824073-(2-Diethylaminoethyl)imidazo(4,5-b)pyridine-6-carboxylic acid, methyl esterRefChem:348813DTXCID80104898methyl 3-[2-(diethylamino)ethyl]-3h-imidazo[4,5-b]pyridine-6-carboxylate3-[2-(Diethylamino)ethyl]-3H-imidazo[4,5-b]pyridine-6-carboxylic acid methyl ester

Database identifiers

CAS: 2813-72-1
PubChem CID: 76055
DTXSID: DTXSID10182407
Nikkaji: J40.954E

Properties

Computed structural properties

XLogP: 1.3
Topological polar surface area: 60.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 20
Formal charge: 0
Complexity: 322

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