N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine

C17H21FN6O2 — CID 1158962

IUPACN-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
SMILESFc1ccccc1Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C17H21FN6O2/c18-13-3-1-2-4-14(13)19-15-20-16(23-5-9-25-10-6-23)22-17(21-15)24-7-11-26-12-8-24/h1-4H,5-12H2,(H,19,20,21,22)
InChIKeyNHPAZBKRRYXMSP-UHFFFAOYSA-N
MW360.39 g/mol
LogP1.43
Rot. Bonds4

About N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine

N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 1158962) has the molecular formula C17H21FN6O2 and a molecular weight of 360.39 g/mol. Its IUPAC name is N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID1158962
Molecular FormulaC17H21FN6O2
Molecular Weight360.39 g/mol
Exact Mass360.17
IUPAC NameN-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine
SMILESFc1ccccc1Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1
InChIInChI=1S/C17H21FN6O2/c18-13-3-1-2-4-14(13)19-15-20-16(23-5-9-25-10-6-23)22-17(21-15)24-7-11-26-12-8-24/h1-4H,5-12H2,(H,19,20,21,22)
InChIKeyNHPAZBKRRYXMSP-UHFFFAOYSA-N
XLogP1.43
TPSA75.64 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

4,6-dimorpholino-N-(4-nitrophenyl)-1,3,5-triazin-2-amine
CID 2834965
2-Anilino-4,6-DI(4-morpholinyl)-1,3,5-triazine
CID 749680
1,3,5-Triazine-2,4-diamine, 6-(4-morpholinyl)-n2,n4-diphenyl-
CID 780750
(4,6-Di-morpholin-4-yl-[1,3,5]triazin-2-yl)-m-tolyl-amine
CID 1117926
N-(4-chlorophenyl)-6-morpholin-4-yl-N'-(2-morpholin-4-ylethyl)-1,3,5-triazine-2,4-diamine
CID 3243109
N-(2-Morpholin-4-yl-ethyl)-N',N''-diphenyl-[1,3,5]triazine-2,4,6-triamine
CID 1095342
(4,6-Diethoxy-[1,3,5]triazin-2-yl)-(2-fluoro-phenyl)-amine
CID 1158964
1-(2-((4,6-Bis(dimethylamino)-1,3,5-triazin-2-yl)oxy)ethyl)-3-phenylurea
CID 658880
N,N'-bis(4-fluorophenyl)-6-(morpholin-4-yl)-1,3,5-triazine-2,4-diamine
CID 1333301
4-(diphenylamino)-N,N,N-trimethyl-6-(morpholin-4-yl)-1,3,5-triazin-2-aminium
CID 3513539
1-(2-((4,6-Bis(diethylamino)-1,3,5-triazin-2-yl)oxy)ethyl)-3-phenylurea
CID 4364919
6-methoxy-N-[2-(4-morpholinyl)ethyl]-N'-phenyl-1,3,5-triazine-2,4-diamine
CID 694565

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine (CID 1158962) is N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine is Fc1ccccc1Nc1nc(N2CCOCC2)nc(N2CCOCC2)n1.
What is the InChIKey of N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is NHPAZBKRRYXMSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN6O2/c18-13-3-1-2-4-14(13)19-15-20-16(23-5-9-25-10-6-23)22-17(21-15)24-7-11-26-12-8-24/h1-4H,5-12H2,(H,19,20,21,22).
What are the key properties of N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine?
N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 360.39 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-4,6-dimorpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 1158962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).