4-fluoro-6-methoxy-N-methylpyrimidin-2-amine

C6H8FN3O — CID 14717233

IUPAC4-fluoro-6-methoxy-N-methylpyrimidin-2-amine
SMILESCNc1nc(F)cc(OC)n1
InChIInChI=1S/C6H8FN3O/c1-8-6-9-4(7)3-5(10-6)11-2/h3H,1-2H3,(H,8,9,10)
InChIKeyHTVYDELMIWEWDA-UHFFFAOYSA-N
MW157.15 g/mol
LogP0.67
Rot. Bonds2

About 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine

4-fluoro-6-methoxy-N-methylpyrimidin-2-amine (PubChem CID 14717233) has the molecular formula C6H8FN3O and a molecular weight of 157.15 g/mol. Its IUPAC name is 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-fluoro-6-methoxy-N-methylpyrimidin-2-amine
PubChem CID14717233
Molecular FormulaC6H8FN3O
Molecular Weight157.15 g/mol
Exact Mass157.07
IUPAC Name4-fluoro-6-methoxy-N-methylpyrimidin-2-amine
SMILESCNc1nc(F)cc(OC)n1
InChIInChI=1S/C6H8FN3O/c1-8-6-9-4(7)3-5(10-6)11-2/h3H,1-2H3,(H,8,9,10)
InChIKeyHTVYDELMIWEWDA-UHFFFAOYSA-N
XLogP0.67
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.15
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine?
The IUPAC name of 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine (CID 14717233) is 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine.
What is the SMILES notation for 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine?
The canonical SMILES for 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine is CNc1nc(F)cc(OC)n1.
What is the InChIKey of 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine?
The InChIKey is HTVYDELMIWEWDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FN3O/c1-8-6-9-4(7)3-5(10-6)11-2/h3H,1-2H3,(H,8,9,10).
What are the key properties of 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine?
4-fluoro-6-methoxy-N-methylpyrimidin-2-amine has a molecular weight of 157.15 g/mol, XLogP of 0.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-methoxy-N-methylpyrimidin-2-amine is sourced from PubChem (CID 14717233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).