2-[4-(Methylamino)-6-propyl-1,3,5-triazin-2-yl]phenol

HCID 705457

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 146998-52-9
Standard SMILES: CCCc1nc(NC)nc(-c2ccccc2O)n1
InChIKey: NNXKYWPOYTVUET-UHFFFAOYSA-N
Molecular formula: C13H16N4O
Average molar mass: 244.29 g/mol
Monoisotopic mass: 244.13241115

Names & identifiers

Preferred name: 2-[4-(Methylamino)-6-propyl-1,3,5-triazin-2-yl]phenol
IUPAC: 2-[4-(methylamino)-6-propyl-1,3,5-triazin-2-yl]phenol

Names & synonyms

146998-52-92-[4-(methylamino)-6-propyl-1,3,5-triazin-2-yl]phenolPhenol, 2-[4-(methylamino)-6-propyl-1,3,5-triazin-2-yl]-2-(4-(methylamino)-6-propyl-1,3,5-triazin-2-yl)phenolChemDiv2_004509Oprea1_382786DTXSID001200079HMS1381M21STK860369AKOS001672478CCG-113778IDI1_003224

Show more names

AE-848/32191056SR-01000505867SR-01000505867-1

Database identifiers

CAS: 146998-52-9
PubChem CID: 705457
DTXSID: DTXSID001200079

Properties

Computed structural properties

XLogP: 2.8
Topological polar surface area: 70.9 Å²
Hydrogen bond donors: 2
Hydrogen bond acceptors: 5
Rotatable bonds: 4
Heavy atoms: 18
Formal charge: 0
Complexity: 251

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…