2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

C18H19FN6O2 — CID 1158965

IUPAC2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESFc1ccccc1Nc1nc(NCc2ccco2)nc(N2CCOCC2)n1
InChIInChI=1S/C18H19FN6O2/c19-14-5-1-2-6-15(14)21-17-22-16(20-12-13-4-3-9-27-13)23-18(24-17)25-7-10-26-11-8-25/h1-6,9H,7-8,10-12H2,(H2,20,21,22,23,24)
InChIKeyUWEFCLLTLZGATO-UHFFFAOYSA-N
MW370.39 g/mol
LogP2.80
Rot. Bonds6

About 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine

2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (PubChem CID 1158965) has the molecular formula C18H19FN6O2 and a molecular weight of 370.39 g/mol. Its IUPAC name is 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
PubChem CID1158965
Molecular FormulaC18H19FN6O2
Molecular Weight370.39 g/mol
Exact Mass370.16
IUPAC Name2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
SMILESFc1ccccc1Nc1nc(NCc2ccco2)nc(N2CCOCC2)n1
InChIInChI=1S/C18H19FN6O2/c19-14-5-1-2-6-15(14)21-17-22-16(20-12-13-4-3-9-27-13)23-18(24-17)25-7-10-26-11-8-25/h1-6,9H,7-8,10-12H2,(H2,20,21,22,23,24)
InChIKeyUWEFCLLTLZGATO-UHFFFAOYSA-N
XLogP2.80
TPSA88.34 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.39
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

4-((4-Chloro-6-((furan-2-ylmethyl)amino)-1,3,5-triazin-2-yl)amino)phenol
CID 556948
6-Chloro-N-furan-2-ylmethyl-N'-(4-methoxy-phenyl)-[1,3,5]triazine-2,4-diamine
CID 694087
N-Furan-2-ylmethyl-N'-(4-isopropyl-phenyl)-6-morpholin-4-yl-[1,3,5]triazine-2,4-diamine
CID 647595
N~3~-(2-furylmethyl)-1-phenyl-1H-1,2,4-triazole-3,5-diamine
CID 884997
6-Chloro-N-(2,4-dimethoxy-phenyl)-N'-furan-2-ylmethyl-[1,3,5]triazine-2,4-diamine
CID 1095341
N2-(furan-2-ylmethyl)-N4-(4-methoxyphenyl)-6-morpholino-1,3,5-triazine-2,4-diamine
CID 1158981
2-[4-(2-fluorophenyl)piperazin-1-yl]-N-(furan-2-ylmethylcarbamoyl)acetamide
CID 2697596
6-Ethoxy-N-(2-fluoro-phenyl)-N'-furan-2-ylmethyl-[1,3,5]triazine-2,4-diamine
CID 3146878
6-chloro-4-N-(furan-2-ylmethyl)-2-N-(4-propan-2-ylphenyl)-1,3,5-triazine-2,4-diamine
CID 790413
N4-(2-furanylmethyl)-N2-(3-methylphenyl)-6-(4-morpholinyl)-1,3,5-triazine-2,4-diamine
CID 651460
6-Ethoxy-N-furan-2-ylmethyl-N'-(4-methoxy-phenyl)-[1,3,5]triazine-2,4-diamine
CID 650272
N-benzyl-N'-(2-furylmethyl)-6-(4-morpholinyl)-1,3,5-triazine-2,4-diamine
CID 1113674

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine (CID 1158965) is 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is Fc1ccccc1Nc1nc(NCc2ccco2)nc(N2CCOCC2)n1.
What is the InChIKey of 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is UWEFCLLTLZGATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN6O2/c19-14-5-1-2-6-15(14)21-17-22-16(20-12-13-4-3-9-27-13)23-18(24-17)25-7-10-26-11-8-25/h1-6,9H,7-8,10-12H2,(H2,20,21,22,23,24).
What are the key properties of 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine?
2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 370.39 g/mol, XLogP of 2.80, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-fluorophenyl)-4-N-(furan-2-ylmethyl)-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 1158965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).