HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program：[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

N-[alpha-(2-methoxyphenyl)benzyl]-4-pyridinamine

HCID 20380334
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccccc1C(Nc1ccncc1)c1ccccc1
InChIKey
VEVQMRDMLDQEDK-UHFFFAOYSA-N
Molecular formula
C19H18N2O
Average molar mass
290.4 g/mol

Names & identifiers

Preferred name
N-[alpha-(2-methoxyphenyl)benzyl]-4-pyridinamine
IUPAC
N-[(2-methoxyphenyl)-phenylmethyl]pyridin-4-amine

Names & synonyms

SCHEMBL11561987VEVQMRDMLDQEDK-UHFFFAOYSA-NN-[alpha-(2-methoxyphenyl)benzyl]-4-pyridinamine

Database identifiers

PubChem CID
20380334

Properties

Computed structural properties

XLogP
4
Topological polar surface area
34.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
22
Formal charge
0
Complexity
311

Related reactions

2 records
New reaction record
HRID 139895 reaction equation
HRID 139895As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 1448602 reaction equation
HRID 1448602As productuspto-grants-1979_12

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes