3H-Imidazo(4,5-b)pyridine, 2-(1-methyl-3-piperidinyl)-3-(phenylmethyl)-

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Basic information

CAS: 132953-12-9
Standard SMILES: CN1CCC(c2nc3cccnc3n2Cc2ccccc2)CC1
InChIKey: HDMRHBXRGMIRNK-UHFFFAOYSA-N
Molecular formula: C19H22N4
Average molar mass: 306.4 g/mol
Monoisotopic mass: 306.18444672

Names & identifiers

Preferred name: 3H-Imidazo(4,5-b)pyridine, 2-(1-methyl-3-piperidinyl)-3-(phenylmethyl)-
IUPAC: 3-benzyl-2-(1-methylpiperidin-4-yl)imidazo[4,5-b]pyridine

Names & synonyms

3H-Imidazo(4,5-b)pyridine, 2-(1-methyl-3-piperidinyl)-3-(phenylmethyl)-3-Benzyl-2-(1-methylpiperidin-3-yl)-3H-imidazo(4,5-b)pyridine132953-12-92-(1-Methyl-3-piperidinyl)-3-(phenylmethyl)-3H-imidazo(4,5-b)pyridineDTXSID30157879RefChem:283129DTXCID5080370SCHEMBL9761903HDMRHBXRGMIRNK-UHFFFAOYSA-N3-benzyl-2-(1-methylpiperidin-4-yl)-3H- imidazo-[4,5-b] pyridine3-Benzyl-2-(1-methylpiperidin-4-yl)-3H-imidazo[4,5-b]pyridine

Database identifiers

CAS: 132953-12-9
PubChem CID: 3076952
DTXSID: DTXSID30157879

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 34 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 23
Formal charge: 0
Complexity: 374

Related reactions

2 records

New reaction record

HRID 811009As productTest data from https://doi.org/10.1039/C8SC04228D

HRID 1460501As productuspto-grants-1991_12

Compound notes

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