4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine

C19H18N4O3 — CID 1240525

IUPAC4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine
SMILESc1ccc(Oc2nc(Oc3ccccc3)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C19H18N4O3/c1-3-7-15(8-4-1)25-18-20-17(23-11-13-24-14-12-23)21-19(22-18)26-16-9-5-2-6-10-16/h1-10H,11-14H2
InChIKeyWGYJXFOORSDUFV-UHFFFAOYSA-N
MW350.38 g/mol
LogP3.29
Rot. Bonds5

About 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine

4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine (PubChem CID 1240525) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine.

Molecular Properties

Compound Name4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine
PubChem CID1240525
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine
SMILESc1ccc(Oc2nc(Oc3ccccc3)nc(N3CCOCC3)n2)cc1
InChIInChI=1S/C19H18N4O3/c1-3-7-15(8-4-1)25-18-20-17(23-11-13-24-14-12-23)21-19(22-18)26-16-9-5-2-6-10-16/h1-10H,11-14H2
InChIKeyWGYJXFOORSDUFV-UHFFFAOYSA-N
XLogP3.29
TPSA69.60 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

[4-Chloro-6-(dimethylamino)-1,3,5-triazin-2-yl](2-phenoxyethyl)cyanamide
CID 614541
2-(4-Cyclohexylphenoxy)-4,6-dimorpholin-4-yl-1,3,5-triazine
CID 3236599
2-(4-Chlorophenoxy)-4,6-di(morpholin-4-yl)-1,3,5-triazine
CID 1086561
[4,6-Bis(dimethylamino)-1,3,5-triazin-2-yl]-[2-(2-methoxyphenoxy)ethyl]cyanamide
CID 3125344
4,6-Bis(ethylamino)-1,3,5-triazin-2-yl(2-phenoxyethyl)cyanamide
CID 828067
2,4-Di-4-morpholinyl-6-phenoxy-1,3,5-triazine
CID 970218
4-[(4,6-Di-4-morpholinyl-1,3,5-triazin-2-yl)oxy]benzonitrile
CID 1086559
[4,6-Bis(dimethylamino)-1,3,5-triazin-2-yl]-(2-phenoxyethyl)cyanamide
CID 694925
4-[4,6-Bis(4-chlorophenoxy)-1,3,5-triazin-2-yl]morpholine
CID 3237426
4-[4,6-Bis(4-fluorophenoxy)-1,3,5-triazin-2-yl]thiomorpholine
CID 2799301
4-[(4-Fluorophenoxy)methyl]-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 729148
N-(4,6-Diphenoxy-1,3,5-triazin-2-YL)-N,N-diethylamine
CID 686437

Frequently Asked Questions

What is the IUPAC name of 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine?
The IUPAC name of 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine (CID 1240525) is 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine.
What is the SMILES notation for 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine?
The canonical SMILES for 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine is c1ccc(Oc2nc(Oc3ccccc3)nc(N3CCOCC3)n2)cc1.
What is the InChIKey of 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine?
The InChIKey is WGYJXFOORSDUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-3-7-15(8-4-1)25-18-20-17(23-11-13-24-14-12-23)21-19(22-18)26-16-9-5-2-6-10-16/h1-10H,11-14H2.
What are the key properties of 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine?
4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine has a molecular weight of 350.38 g/mol, XLogP of 3.29, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,6-diphenoxy-1,3,5-triazin-2-yl)morpholine is sourced from PubChem (CID 1240525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).