5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine

C6H8FN3 — CID 58226895

IUPAC5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine
SMILESC=C1N=C(N)C(F)=CN1C
InChIInChI=1S/C6H8FN3/c1-4-9-6(8)5(7)3-10(4)2/h3H,1H2,2H3,(H2,8,9)
InChIKeyQRPQIQBEVAMWKZ-UHFFFAOYSA-N
MW141.15 g/mol
LogP0.57
Rot. Bonds

About 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine

5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine (PubChem CID 58226895) has the molecular formula C6H8FN3 and a molecular weight of 141.15 g/mol. Its IUPAC name is 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine.

Molecular Properties

Compound Name5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine
PubChem CID58226895
Molecular FormulaC6H8FN3
Molecular Weight141.15 g/mol
Exact Mass141.07
IUPAC Name5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine
SMILESC=C1N=C(N)C(F)=CN1C
InChIInChI=1S/C6H8FN3/c1-4-9-6(8)5(7)3-10(4)2/h3H,1H2,2H3,(H2,8,9)
InChIKeyQRPQIQBEVAMWKZ-UHFFFAOYSA-N
XLogP0.57
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.15
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine?
The IUPAC name of 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine (CID 58226895) is 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine.
What is the SMILES notation for 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine?
The canonical SMILES for 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine is C=C1N=C(N)C(F)=CN1C.
What is the InChIKey of 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine?
The InChIKey is QRPQIQBEVAMWKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FN3/c1-4-9-6(8)5(7)3-10(4)2/h3H,1H2,2H3,(H2,8,9).
What are the key properties of 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine?
5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine has a molecular weight of 141.15 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1-methyl-2-methylidenepyrimidin-4-amine is sourced from PubChem (CID 58226895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).