Molecule ID: 15359

IUPAC Name: 4-N-ethyl-6-methoxy-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

Description: The molecule is a diamino-1,3,5-triazine that is N-ethyl-N'-(propan-2-yl)-1,3,5-triazine-2,4-diamine substituted by a methoxy group at position 6. It is an agrochemical used as a herbicide. It has a role as an environmental contaminant, a xenobiotic, an agrochemical and a herbicide. It is a diamino-1,3,5-triazine and a methoxy-1,3,5-triazine.

SMILES: CCN=c1nc(OC)[nH]c(=NC(C)C)[nH]1

SELFIES: [C][C][N][=C][N][=C][Branch1][Ring1][O][C][NH1][C][=Branch1][#Branch1][=N][C][Branch1][C][C][C][NH1][Ring1][N]

InChI: InChI=1S/C9H17N5O/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)

Molecular Properties:
- Polar Surface Area: 72.0 Ų
- LogP: 2.7