N-tert-Butoxycarbonyl-N-(2-pyridinylmethyl)-N'-(8-methyl-5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamine

HCID 22018645

Basic information

Standard SMILES
CC(C)(C)OC(=O)N(Cc1ccc(CNC2(C)CCCc3cccnc32)cc1)Cc1ccccn1
InChIKey
DVNFDCGCQVCXQO-UHFFFAOYSA-N
Molecular formula
C29H36N4O2
Average molar mass
472.6 g/mol

Names & identifiers

Preferred name
N-tert-Butoxycarbonyl-N-(2-pyridinylmethyl)-N'-(8-methyl-5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamine
IUPAC
tert-butyl N-[[4-[[(8-methyl-6,7-dihydro-5H-quinolin-8-yl)amino]methyl]phenyl]methyl]-N-(pyridin-2-ylmethyl)carbamate

Names & synonyms

SCHEMBL4064150DVNFDCGCQVCXQO-UHFFFAOYSA-NN-tert-Butoxycarbonyl-N-(2-pyridinylmethyl)-N'-(8-methyl-5,6,7,8-tetrahydro-8-quinolinyl)-1,4-benzenedimethanamine

Database identifiers

PubChem CID
22018645

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
67.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
35

Related reactions

5 records

Compound notes

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