4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine

C6H9FN4 — CID 54329421

IUPAC4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine
SMILESCc1nc(F)nc(N(C)C)n1
InChIInChI=1S/C6H9FN4/c1-4-8-5(7)10-6(9-4)11(2)3/h1-3H3
InChIKeySXHBMHIEMOTFIM-UHFFFAOYSA-N
MW156.16 g/mol
LogP0.39
Rot. Bonds1

About 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine

4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine (PubChem CID 54329421) has the molecular formula C6H9FN4 and a molecular weight of 156.16 g/mol. Its IUPAC name is 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine
PubChem CID54329421
Molecular FormulaC6H9FN4
Molecular Weight156.16 g/mol
Exact Mass156.08
IUPAC Name4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine
SMILESCc1nc(F)nc(N(C)C)n1
InChIInChI=1S/C6H9FN4/c1-4-8-5(7)10-6(9-4)11(2)3/h1-3H3
InChIKeySXHBMHIEMOTFIM-UHFFFAOYSA-N
XLogP0.39
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 50.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine (CID 54329421) is 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine is Cc1nc(F)nc(N(C)C)n1.
What is the InChIKey of 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine?
The InChIKey is SXHBMHIEMOTFIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN4/c1-4-8-5(7)10-6(9-4)11(2)3/h1-3H3.
What are the key properties of 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine?
4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine has a molecular weight of 156.16 g/mol, XLogP of 0.39, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N,N,6-trimethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 54329421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).