4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine

C30H32N6O2 — CID 121350336

IUPAC4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine
SMILESc1ccc(OC2CCN(c3nc(N4CCOCC4)nc(N(c4ccccc4)c4ccccc4)n3)CC2)cc1
InChIInChI=1S/C30H32N6O2/c1-4-10-24(11-5-1)36(25-12-6-2-7-13-25)30-32-28(31-29(33-30)35-20-22-37-23-21-35)34-18-16-27(17-19-34)38-26-14-8-3-9-15-26/h1-15,27H,16-23H2
InChIKeyMYOCQYFKHDQOGK-UHFFFAOYSA-N
MW508.63 g/mol
LogP5.23
Rot. Bonds7

About 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine

4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine (PubChem CID 121350336) has the molecular formula C30H32N6O2 and a molecular weight of 508.63 g/mol. Its IUPAC name is 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine
PubChem CID121350336
Molecular FormulaC30H32N6O2
Molecular Weight508.63 g/mol
Exact Mass508.26
IUPAC Name4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine
SMILESc1ccc(OC2CCN(c3nc(N4CCOCC4)nc(N(c4ccccc4)c4ccccc4)n3)CC2)cc1
InChIInChI=1S/C30H32N6O2/c1-4-10-24(11-5-1)36(25-12-6-2-7-13-25)30-32-28(31-29(33-30)35-20-22-37-23-21-35)34-18-16-27(17-19-34)38-26-14-8-3-9-15-26/h1-15,27H,16-23H2
InChIKeyMYOCQYFKHDQOGK-UHFFFAOYSA-N
XLogP5.23
TPSA66.85 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500508.63
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-(azepan-1-yl)-6-morpholin-4-yl-N,N-diphenyl-1,3,5-triazin-2-amine
CID 3927094
4-[4-(4-fluorophenoxy)piperidin-1-yl]-N-(4-fluorophenyl)-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 121354771
4-[4-(4-fluorophenoxy)piperidin-1-yl]-N,N-dimethyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 121350344
trimethyl-[4-morpholin-4-yl-6-(N-phenylanilino)-1,3,5-triazin-2-yl]azanium chloride
CID 11270270
2-N-ethyl-6-morpholin-4-yl-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
CID 645138
2-N,4-N-dimethyl-6-morpholin-4-yl-2-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine;dihydrochloride
CID 16955716
2-N-hexyl-6-morpholin-4-yl-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
CID 2172668
4-phenoxyoxane
CID 58483739
4-chloro-2-(4-phenoxypiperidin-1-yl)pyrimidine
CID 176574621
2-(4-phenoxypiperidin-1-yl)acetamide
CID 47395345
4,5,6-trimethyl-2-[(3R)-3-phenoxypyrrolidin-1-yl]pyrimidine
CID 163306506
2-N-[[4-(dimethylamino)phenyl]methylideneamino]-6-morpholin-4-yl-4-N,4-N-diphenyl-1,3,5-triazine-2,4-diamine
CID 4289951

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine (CID 121350336) is 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine is c1ccc(OC2CCN(c3nc(N4CCOCC4)nc(N(c4ccccc4)c4ccccc4)n3)CC2)cc1.
What is the InChIKey of 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine?
The InChIKey is MYOCQYFKHDQOGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32N6O2/c1-4-10-24(11-5-1)36(25-12-6-2-7-13-25)30-32-28(31-29(33-30)35-20-22-37-23-21-35)34-18-16-27(17-19-34)38-26-14-8-3-9-15-26/h1-15,27H,16-23H2.
What are the key properties of 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine?
4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine has a molecular weight of 508.63 g/mol, XLogP of 5.23, 7 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-yl-6-(4-phenoxypiperidin-1-yl)-N,N-diphenyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 121350336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).