5-fluoro-2-(methoxymethyl)-4-methylpyrimidine

C7H9FN2O — CID 163887109

IUPAC5-fluoro-2-(methoxymethyl)-4-methylpyrimidine
SMILESCOCc1ncc(F)c(C)n1
InChIInChI=1S/C7H9FN2O/c1-5-6(8)3-9-7(10-5)4-11-2/h3H,4H2,1-2H3
InChIKeyPYHXZRVUNDNEJL-UHFFFAOYSA-N
MW156.16 g/mol
LogP1.07
Rot. Bonds2

About 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine

5-fluoro-2-(methoxymethyl)-4-methylpyrimidine (PubChem CID 163887109) has the molecular formula C7H9FN2O and a molecular weight of 156.16 g/mol. Its IUPAC name is 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine.

Molecular Properties

Compound Name5-fluoro-2-(methoxymethyl)-4-methylpyrimidine
PubChem CID163887109
Molecular FormulaC7H9FN2O
Molecular Weight156.16 g/mol
Exact Mass156.07
IUPAC Name5-fluoro-2-(methoxymethyl)-4-methylpyrimidine
SMILESCOCc1ncc(F)c(C)n1
InChIInChI=1S/C7H9FN2O/c1-5-6(8)3-9-7(10-5)4-11-2/h3H,4H2,1-2H3
InChIKeyPYHXZRVUNDNEJL-UHFFFAOYSA-N
XLogP1.07
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.16
LogP ≤ 51.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine?
The IUPAC name of 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine (CID 163887109) is 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine.
What is the SMILES notation for 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine?
The canonical SMILES for 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine is COCc1ncc(F)c(C)n1.
What is the InChIKey of 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine?
The InChIKey is PYHXZRVUNDNEJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2O/c1-5-6(8)3-9-7(10-5)4-11-2/h3H,4H2,1-2H3.
What are the key properties of 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine?
5-fluoro-2-(methoxymethyl)-4-methylpyrimidine has a molecular weight of 156.16 g/mol, XLogP of 1.07, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-(methoxymethyl)-4-methylpyrimidine is sourced from PubChem (CID 163887109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).