4,6-diphenoxy-1,3,5-triazin-2-amine

C15H12N4O2 — CID 14685

IUPAC4,6-diphenoxy-1,3,5-triazin-2-amine
SMILESNc1nc(Oc2ccccc2)nc(Oc2ccccc2)n1
InChIInChI=1S/C15H12N4O2/c16-13-17-14(20-11-7-3-1-4-8-11)19-15(18-13)21-12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19)
InChIKeyJGKMMDYFVHTJJG-UHFFFAOYSA-N
MW280.29 g/mol
LogP3.04
Rot. Bonds4

About 4,6-diphenoxy-1,3,5-triazin-2-amine

4,6-diphenoxy-1,3,5-triazin-2-amine (PubChem CID 14685) has the molecular formula C15H12N4O2 and a molecular weight of 280.29 g/mol. Its IUPAC name is 4,6-diphenoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-diphenoxy-1,3,5-triazin-2-amine
PubChem CID14685
Molecular FormulaC15H12N4O2
Molecular Weight280.29 g/mol
Exact Mass280.10
IUPAC Name4,6-diphenoxy-1,3,5-triazin-2-amine
SMILESNc1nc(Oc2ccccc2)nc(Oc2ccccc2)n1
InChIInChI=1S/C15H12N4O2/c16-13-17-14(20-11-7-3-1-4-8-11)19-15(18-13)21-12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19)
InChIKeyJGKMMDYFVHTJJG-UHFFFAOYSA-N
XLogP3.04
TPSA83.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,4,6-Triphenoxy-s-triazine
CID 15973
6-(2-Phenoxyethoxy)-1,3,5-triazine-2,4-diamine
CID 25271557
2,4,6-Tris(4-methoxyphenoxy)-1,3,5-triazine
CID 260088
2,4,6-Tris(4-fluorophenoxy)-1,3,5-triazine
CID 10573660
6-Phenoxy-1,3,5-triazine-2,4-diamine
CID 15111
4-Chloro-6-(4-methoxyphenoxy)-1,3,5-triazin-2-amine
CID 14724248
2-Chloro-4,6-bis(4-methylphenoxy)-1,3,5-triazine
CID 35653
2,4-Dichloro-6-(4-fluorophenoxy)-1,3,5-triazine
CID 2782796
2,4,6-Tris(2-methoxyphenoxy)-1,3,5-triazine
CID 4094680
2-(3-Iodophenoxy)-4,6-dimethoxy-1,3,5-triazine
CID 62859977
2,4-Dichloro-6-phenoxy-1,3,5-triazine
CID 20807
2,4-Dimethoxy-6-phenoxy-1,3,5-triazine
CID 793499

Frequently Asked Questions

What is the IUPAC name of 4,6-diphenoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-diphenoxy-1,3,5-triazin-2-amine (CID 14685) is 4,6-diphenoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-diphenoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-diphenoxy-1,3,5-triazin-2-amine is Nc1nc(Oc2ccccc2)nc(Oc2ccccc2)n1.
What is the InChIKey of 4,6-diphenoxy-1,3,5-triazin-2-amine?
The InChIKey is JGKMMDYFVHTJJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O2/c16-13-17-14(20-11-7-3-1-4-8-11)19-15(18-13)21-12-9-5-2-6-10-12/h1-10H,(H2,16,17,18,19).
What are the key properties of 4,6-diphenoxy-1,3,5-triazin-2-amine?
4,6-diphenoxy-1,3,5-triazin-2-amine has a molecular weight of 280.29 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-diphenoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 14685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).