N-(4-Methoxyphenyl)-2-[1-(4-pyridyl)piperidin-4-ylmethyl]aminopyridine-3-carboxamide

HCID 9844870

Notes Reactions

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Basic information

Standard SMILES: COc1ccc(NC(=O)c2cccnc2NCC2CCN(c3ccncc3)CC2)cc1
InChIKey: GXLHTPASRPMTCE-UHFFFAOYSA-N
Molecular formula: C24H27N5O2
Average molar mass: 417.5 g/mol

Names & identifiers

Preferred name: N-(4-Methoxyphenyl)-2-[1-(4-pyridyl)piperidin-4-ylmethyl]aminopyridine-3-carboxamide
IUPAC: N-(4-methoxyphenyl)-2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]pyridine-3-carboxamide

Names & synonyms

SCHEMBL5760386GXLHTPASRPMTCE-UHFFFAOYSA-NN-(4-Methoxyphenyl)-2-[1-(4-pyridyl)-piperidin-4-ylmethyl]aminopyridine-3-carboxamiden-(4-methoxyphenyl)-2-[1-(4-pyridyl)piperidin-4-yl-methyl]aminopyridine-3-carboxamideN-(4-Methoxyphenyl)-2-[1-(4-pyridyl)piperidin-4-ylmethyl]aminopyridine-3-carboxamide

Database identifiers

PubChem CID: 9844870

Properties

Computed structural properties

XLogP: 4
Topological polar surface area: 79.4 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 6
Rotatable bonds: 7
Heavy atoms: 31
Formal charge: 0
Complexity: 540

Related reactions

7 records

New reaction record

HRID 49845As productuspto-grants-2004_03

HRID 137631As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

HRID 397545As productuspto-grants-2003_08

HRID 675048As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

HRID 1837169As productuspto-grants-2004_08

HRID 2083930As productuspto-grants-2004_04

HRID 2084308As productuspto-grants-2004_04

Compound notes

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