4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine

C13H15FN4O2 — CID 80869841

IUPAC4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
SMILESCCCNc1nc(OC)nc(Oc2cccc(F)c2)n1
InChIInChI=1S/C13H15FN4O2/c1-3-7-15-11-16-12(19-2)18-13(17-11)20-10-6-4-5-9(14)8-10/h4-6,8H,3,7H2,1-2H3,(H,15,16,17,18)
InChIKeyPSGFJJJXZOYNEO-UHFFFAOYSA-N
MW278.29 g/mol
LogP2.63
Rot. Bonds6

About 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine

4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine (PubChem CID 80869841) has the molecular formula C13H15FN4O2 and a molecular weight of 278.29 g/mol. Its IUPAC name is 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
PubChem CID80869841
Molecular FormulaC13H15FN4O2
Molecular Weight278.29 g/mol
Exact Mass278.12
IUPAC Name4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
SMILESCCCNc1nc(OC)nc(Oc2cccc(F)c2)n1
InChIInChI=1S/C13H15FN4O2/c1-3-7-15-11-16-12(19-2)18-13(17-11)20-10-6-4-5-9(14)8-10/h4-6,8H,3,7H2,1-2H3,(H,15,16,17,18)
InChIKeyPSGFJJJXZOYNEO-UHFFFAOYSA-N
XLogP2.63
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.29
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-methoxy-6-(3-methoxyphenoxy)-N-propyl-1,3,5-triazin-2-amine
CID 80865867
4-(3-bromo-4-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 83232385
4-(3-chloro-2-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 116691277
4-ethoxy-6-(4-fluorophenoxy)-N-propyl-1,3,5-triazin-2-amine
CID 80865729
4-[(5-chloro-3-pyridinyl)oxy]-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 80878172
2-N,2-N-dimethyl-6-phenoxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80869615
2-N-(3-fluoro-4-methylphenyl)-6-methoxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80750770
6-methoxy-4-N-propyl-2-N-pyridin-3-yl-1,3,5-triazine-2,4-diamine
CID 117092308
[4-(3-ethoxyphenoxy)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
CID 80930359
4-chloro-6-(3-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine
CID 80870186
2-N-(2-bromo-6-fluorophenyl)-6-methoxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 107604531
4-[(3-chlorophenyl)methoxy]-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 80871605

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine (CID 80869841) is 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine is CCCNc1nc(OC)nc(Oc2cccc(F)c2)n1.
What is the InChIKey of 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine?
The InChIKey is PSGFJJJXZOYNEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4O2/c1-3-7-15-11-16-12(19-2)18-13(17-11)20-10-6-4-5-9(14)8-10/h4-6,8H,3,7H2,1-2H3,(H,15,16,17,18).
What are the key properties of 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine?
4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine has a molecular weight of 278.29 g/mol, XLogP of 2.63, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenoxy)-6-methoxy-N-propyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80869841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).