2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine

C7H8FN3 — CID 58224680

IUPAC2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine
SMILESC=C(C)c1nc(C)nc(F)n1
InChIInChI=1S/C7H8FN3/c1-4(2)6-9-5(3)10-7(8)11-6/h1H2,2-3H3
InChIKeyANNDUPWVXUWUJG-UHFFFAOYSA-N
MW153.16 g/mol
LogP1.35
Rot. Bonds1

About 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine

2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine (PubChem CID 58224680) has the molecular formula C7H8FN3 and a molecular weight of 153.16 g/mol. Its IUPAC name is 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine.

Molecular Properties

Compound Name2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine
PubChem CID58224680
Molecular FormulaC7H8FN3
Molecular Weight153.16 g/mol
Exact Mass153.07
IUPAC Name2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine
SMILESC=C(C)c1nc(C)nc(F)n1
InChIInChI=1S/C7H8FN3/c1-4(2)6-9-5(3)10-7(8)11-6/h1H2,2-3H3
InChIKeyANNDUPWVXUWUJG-UHFFFAOYSA-N
XLogP1.35
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.16
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine?
The IUPAC name of 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine (CID 58224680) is 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine.
What is the SMILES notation for 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine?
The canonical SMILES for 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine is C=C(C)c1nc(C)nc(F)n1.
What is the InChIKey of 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine?
The InChIKey is ANNDUPWVXUWUJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FN3/c1-4(2)6-9-5(3)10-7(8)11-6/h1H2,2-3H3.
What are the key properties of 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine?
2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine has a molecular weight of 153.16 g/mol, XLogP of 1.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-methyl-6-prop-1-en-2-yl-1,3,5-triazine is sourced from PubChem (CID 58224680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).