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

C6H8FN3 — CID 68547943

IUPAC2-(2-fluoropropan-2-yl)-1,3,5-triazine
SMILESCC(C)(F)c1ncncn1
InChIInChI=1S/C6H8FN3/c1-6(2,7)5-9-3-8-4-10-5/h3-4H,1-2H3
InChIKeyXMCGZBQDTFUWHM-UHFFFAOYSA-N
MW141.15 g/mol
LogP1.08
Rot. Bonds1

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

2-(2-fluoropropan-2-yl)-1,3,5-triazine (PubChem CID 68547943) has the molecular formula C6H8FN3 and a molecular weight of 141.15 g/mol. Its IUPAC name is 2-(2-fluoropropan-2-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(2-fluoropropan-2-yl)-1,3,5-triazine
PubChem CID68547943
Molecular FormulaC6H8FN3
Molecular Weight141.15 g/mol
Exact Mass141.07
IUPAC Name2-(2-fluoropropan-2-yl)-1,3,5-triazine
SMILESCC(C)(F)c1ncncn1
InChIInChI=1S/C6H8FN3/c1-6(2,7)5-9-3-8-4-10-5/h3-4H,1-2H3
InChIKeyXMCGZBQDTFUWHM-UHFFFAOYSA-N
XLogP1.08
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.15
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Tert-butyl-4-chloro-1,3,5-triazine
CID 58795800
2-Methyl-1,3,5-triazine
CID 19208
2-Ethyl-1,3,5-triazine
CID 19193
2,4-Diethyl-1,3,5-triazine
CID 19194
4-Isopropyl-1,3,5-triazin-2-amine
CID 21138957
2-(1-Fluoroethyl)-1,3,5-triazine
CID 18964718
2-(1,1,2,2-Tetrafluoroethyl)-1,3,5-triazine
CID 23165635
2-(1-Fluoropropan-2-yl)-1,3,5-triazine
CID 23183711
2-Fluoro-4-methyl-1,3,5-triazine
CID 53689385
2-Ethyl-4-fluoro-1,3,5-triazine
CID 54234250
2-(Fluoromethyl)-1,3,5-triazine
CID 57014060
4-(1,1,2-Trifluoroethyl)-1,3,5-triazin-2-amine
CID 67912023

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoropropan-2-yl)-1,3,5-triazine?
The IUPAC name of 2-(2-fluoropropan-2-yl)-1,3,5-triazine (CID 68547943) is 2-(2-fluoropropan-2-yl)-1,3,5-triazine.
What is the SMILES notation for 2-(2-fluoropropan-2-yl)-1,3,5-triazine?
The canonical SMILES for 2-(2-fluoropropan-2-yl)-1,3,5-triazine is CC(C)(F)c1ncncn1.
What is the InChIKey of 2-(2-fluoropropan-2-yl)-1,3,5-triazine?
The InChIKey is XMCGZBQDTFUWHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FN3/c1-6(2,7)5-9-3-8-4-10-5/h3-4H,1-2H3.
What are the key properties of 2-(2-fluoropropan-2-yl)-1,3,5-triazine?
2-(2-fluoropropan-2-yl)-1,3,5-triazine has a molecular weight of 141.15 g/mol, XLogP of 1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoropropan-2-yl)-1,3,5-triazine is sourced from PubChem (CID 68547943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).