5-fluoro-2-methylpyrimidine-4,6-diamine

C5H7FN4 — CID 57422049

IUPAC5-fluoro-2-methylpyrimidine-4,6-diamine
SMILESCc1nc(N)c(F)c(N)n1
InChIInChI=1S/C5H7FN4/c1-2-9-4(7)3(6)5(8)10-2/h1H3,(H4,7,8,9,10)
InChIKeyJMOGWEUSJOTSQA-UHFFFAOYSA-N
MW142.14 g/mol
LogP0.09
Rot. Bonds

About 5-fluoro-2-methylpyrimidine-4,6-diamine

5-fluoro-2-methylpyrimidine-4,6-diamine (PubChem CID 57422049) has the molecular formula C5H7FN4 and a molecular weight of 142.14 g/mol. Its IUPAC name is 5-fluoro-2-methylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name5-fluoro-2-methylpyrimidine-4,6-diamine
PubChem CID57422049
Molecular FormulaC5H7FN4
Molecular Weight142.14 g/mol
Exact Mass142.07
IUPAC Name5-fluoro-2-methylpyrimidine-4,6-diamine
SMILESCc1nc(N)c(F)c(N)n1
InChIInChI=1S/C5H7FN4/c1-2-9-4(7)3(6)5(8)10-2/h1H3,(H4,7,8,9,10)
InChIKeyJMOGWEUSJOTSQA-UHFFFAOYSA-N
XLogP0.09
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.14
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-methylpyrimidine-4,6-diamine?
The IUPAC name of 5-fluoro-2-methylpyrimidine-4,6-diamine (CID 57422049) is 5-fluoro-2-methylpyrimidine-4,6-diamine.
What is the SMILES notation for 5-fluoro-2-methylpyrimidine-4,6-diamine?
The canonical SMILES for 5-fluoro-2-methylpyrimidine-4,6-diamine is Cc1nc(N)c(F)c(N)n1.
What is the InChIKey of 5-fluoro-2-methylpyrimidine-4,6-diamine?
The InChIKey is JMOGWEUSJOTSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7FN4/c1-2-9-4(7)3(6)5(8)10-2/h1H3,(H4,7,8,9,10).
What are the key properties of 5-fluoro-2-methylpyrimidine-4,6-diamine?
5-fluoro-2-methylpyrimidine-4,6-diamine has a molecular weight of 142.14 g/mol, XLogP of 0.09, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methylpyrimidine-4,6-diamine is sourced from PubChem (CID 57422049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).