2-(1-fluoropropan-2-yl)-1,3,5-triazine

C6H8FN3 — CID 23183711

IUPAC2-(1-fluoropropan-2-yl)-1,3,5-triazine
SMILESCC(CF)c1ncncn1
InChIInChI=1S/C6H8FN3/c1-5(2-7)6-9-3-8-4-10-6/h3-5H,2H2,1H3
InChIKeyNGJGDADLCVBTPH-UHFFFAOYSA-N
MW141.15 g/mol
LogP0.94
Rot. Bonds2

About 2-(1-fluoropropan-2-yl)-1,3,5-triazine

2-(1-fluoropropan-2-yl)-1,3,5-triazine (PubChem CID 23183711) has the molecular formula C6H8FN3 and a molecular weight of 141.15 g/mol. Its IUPAC name is 2-(1-fluoropropan-2-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(1-fluoropropan-2-yl)-1,3,5-triazine
PubChem CID23183711
Molecular FormulaC6H8FN3
Molecular Weight141.15 g/mol
Exact Mass141.07
IUPAC Name2-(1-fluoropropan-2-yl)-1,3,5-triazine
SMILESCC(CF)c1ncncn1
InChIInChI=1S/C6H8FN3/c1-5(2-7)6-9-3-8-4-10-6/h3-5H,2H2,1H3
InChIKeyNGJGDADLCVBTPH-UHFFFAOYSA-N
XLogP0.94
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.15
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-fluoropropan-2-yl)-1,3,5-triazine?
The IUPAC name of 2-(1-fluoropropan-2-yl)-1,3,5-triazine (CID 23183711) is 2-(1-fluoropropan-2-yl)-1,3,5-triazine.
What is the SMILES notation for 2-(1-fluoropropan-2-yl)-1,3,5-triazine?
The canonical SMILES for 2-(1-fluoropropan-2-yl)-1,3,5-triazine is CC(CF)c1ncncn1.
What is the InChIKey of 2-(1-fluoropropan-2-yl)-1,3,5-triazine?
The InChIKey is NGJGDADLCVBTPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FN3/c1-5(2-7)6-9-3-8-4-10-6/h3-5H,2H2,1H3.
What are the key properties of 2-(1-fluoropropan-2-yl)-1,3,5-triazine?
2-(1-fluoropropan-2-yl)-1,3,5-triazine has a molecular weight of 141.15 g/mol, XLogP of 0.94, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-fluoropropan-2-yl)-1,3,5-triazine is sourced from PubChem (CID 23183711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).