4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine

C19H20N4O4 — CID 117093506

IUPAC4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(Nc2cc(OC)c(OC)c(OC)c2)nc(-c2ccccc2)n1
InChIInChI=1S/C19H20N4O4/c1-24-14-10-13(11-15(25-2)16(14)26-3)20-18-21-17(22-19(23-18)27-4)12-8-6-5-7-9-12/h5-11H,1-4H3,(H,20,21,22,23)
InChIKeyZPUHAMGZEYWESP-UHFFFAOYSA-N
MW368.39 g/mol
LogP3.32
Rot. Bonds7

About 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine

4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine (PubChem CID 117093506) has the molecular formula C19H20N4O4 and a molecular weight of 368.39 g/mol. Its IUPAC name is 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine
PubChem CID117093506
Molecular FormulaC19H20N4O4
Molecular Weight368.39 g/mol
Exact Mass368.15
IUPAC Name4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(Nc2cc(OC)c(OC)c(OC)c2)nc(-c2ccccc2)n1
InChIInChI=1S/C19H20N4O4/c1-24-14-10-13(11-15(25-2)16(14)26-3)20-18-21-17(22-19(23-18)27-4)12-8-6-5-7-9-12/h5-11H,1-4H3,(H,20,21,22,23)
InChIKeyZPUHAMGZEYWESP-UHFFFAOYSA-N
XLogP3.32
TPSA87.62 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.39
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine (CID 117093506) is 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine is COc1nc(Nc2cc(OC)c(OC)c(OC)c2)nc(-c2ccccc2)n1.
What is the InChIKey of 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine?
The InChIKey is ZPUHAMGZEYWESP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O4/c1-24-14-10-13(11-15(25-2)16(14)26-3)20-18-21-17(22-19(23-18)27-4)12-8-6-5-7-9-12/h5-11H,1-4H3,(H,20,21,22,23).
What are the key properties of 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine?
4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine has a molecular weight of 368.39 g/mol, XLogP of 3.32, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-6-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 117093506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).