4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine

C12H13FN4O2 — CID 80863784

IUPAC4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine
SMILESCCOc1nc(NC)nc(Oc2ccccc2F)n1
InChIInChI=1S/C12H13FN4O2/c1-3-18-11-15-10(14-2)16-12(17-11)19-9-7-5-4-6-8(9)13/h4-7H,3H2,1-2H3,(H,14,15,16,17)
InChIKeyNAEFAJYTAJKSTN-UHFFFAOYSA-N
MW264.26 g/mol
LogP2.24
Rot. Bonds5

About 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine

4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine (PubChem CID 80863784) has the molecular formula C12H13FN4O2 and a molecular weight of 264.26 g/mol. Its IUPAC name is 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine
PubChem CID80863784
Molecular FormulaC12H13FN4O2
Molecular Weight264.26 g/mol
Exact Mass264.10
IUPAC Name4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine
SMILESCCOc1nc(NC)nc(Oc2ccccc2F)n1
InChIInChI=1S/C12H13FN4O2/c1-3-18-11-15-10(14-2)16-12(17-11)19-9-7-5-4-6-8(9)13/h4-7H,3H2,1-2H3,(H,14,15,16,17)
InChIKeyNAEFAJYTAJKSTN-UHFFFAOYSA-N
XLogP2.24
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.26
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-ethoxy-N-methyl-6-(2-nitrophenoxy)-1,3,5-triazin-2-amine
CID 80875232
4-chloro-6-(2-ethoxyphenoxy)-N-methyl-1,3,5-triazin-2-amine
CID 80863834
4-(2-methoxyphenoxy)-N-methyl-6-propoxy-1,3,5-triazin-2-amine
CID 80867540
4-ethoxy-N-methyl-6-phenylmethoxy-1,3,5-triazin-2-amine
CID 80859346
4-ethoxy-6-(2-fluoro-3-methoxyphenyl)-N-methyl-1,3,5-triazin-2-amine
CID 82812014
4-methoxy-N-methyl-6-(2-propoxyphenoxy)-1,3,5-triazin-2-amine
CID 80867250
[4-ethoxy-6-(2-fluoro-5-methylphenoxy)-1,3,5-triazin-2-yl]hydrazine
CID 80921400
6-ethoxy-2-N-[(4-fluorophenyl)methyl]-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80777450
[4-(5-bromo-2-fluorophenoxy)-6-ethoxy-1,3,5-triazin-2-yl]hydrazine
CID 114677402
4-(2-butan-2-ylphenoxy)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80874064
2-[(4-chloro-6-ethoxy-1,3,5-triazin-2-yl)oxy]-6-fluorobenzonitrile
CID 62859550
[4-ethoxy-6-[2-[(E)-prop-1-enyl]phenoxy]-1,3,5-triazin-2-yl]hydrazine
CID 80906142

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine (CID 80863784) is 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine is CCOc1nc(NC)nc(Oc2ccccc2F)n1.
What is the InChIKey of 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine?
The InChIKey is NAEFAJYTAJKSTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN4O2/c1-3-18-11-15-10(14-2)16-12(17-11)19-9-7-5-4-6-8(9)13/h4-7H,3H2,1-2H3,(H,14,15,16,17).
What are the key properties of 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine?
4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine has a molecular weight of 264.26 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-(2-fluorophenoxy)-N-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80863784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).