2-fluoro-5-methoxypyrimidine

C5H5FN2O — CID 581840

IUPAC2-fluoro-5-methoxypyrimidine
SMILESCOc1cnc(F)nc1
InChIInChI=1S/C5H5FN2O/c1-9-4-2-7-5(6)8-3-4/h2-3H,1H3
InChIKeyWUUQHVUQKBFFMU-UHFFFAOYSA-N
MW128.11 g/mol
LogP0.62
Rot. Bonds1

About 2-fluoro-5-methoxypyrimidine

2-fluoro-5-methoxypyrimidine (PubChem CID 581840) has the molecular formula C5H5FN2O and a molecular weight of 128.11 g/mol. Its IUPAC name is 2-fluoro-5-methoxypyrimidine.

Molecular Properties

Compound Name2-fluoro-5-methoxypyrimidine
PubChem CID581840
Molecular FormulaC5H5FN2O
Molecular Weight128.11 g/mol
Exact Mass128.04
IUPAC Name2-fluoro-5-methoxypyrimidine
SMILESCOc1cnc(F)nc1
InChIInChI=1S/C5H5FN2O/c1-9-4-2-7-5(6)8-3-4/h2-3H,1H3
InChIKeyWUUQHVUQKBFFMU-UHFFFAOYSA-N
XLogP0.62
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.11
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-5-methoxypyrimidine
CID 2305244
Pyrimidin-5-ol
CID 565855
2-Amino-5-hydroxypyrimidine
CID 17750388
5-Pyrimidinol, 2-(1,1-dimethylethyl)-, sodium salt (1:1)
CID 44152889
2-Chloro-5-methoxypyrimidine
CID 589058
2,4-Dichloro-5-methoxypyrimidine
CID 601401
2-Methanesulfonyl-5-methoxy-pyrimidine
CID 4159151
4-Pyrimidinamine, 2,5-dimethoxy-
CID 250370
5-Methoxypyrimidin-4-amine
CID 817704
5-(1-Methyl-pyrrolidin-3-yloxy)-pyrimidine
CID 44325618
5-methoxy-4-N-prop-2-enylpyrimidine-2,4-diamine
CID 89037059
5-methoxy-4-N-(4,4,4-trifluorobutyl)pyrimidine-2,4-diamine
CID 89966608

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5-methoxypyrimidine?
The IUPAC name of 2-fluoro-5-methoxypyrimidine (CID 581840) is 2-fluoro-5-methoxypyrimidine.
What is the SMILES notation for 2-fluoro-5-methoxypyrimidine?
The canonical SMILES for 2-fluoro-5-methoxypyrimidine is COc1cnc(F)nc1.
What is the InChIKey of 2-fluoro-5-methoxypyrimidine?
The InChIKey is WUUQHVUQKBFFMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5FN2O/c1-9-4-2-7-5(6)8-3-4/h2-3H,1H3.
What are the key properties of 2-fluoro-5-methoxypyrimidine?
2-fluoro-5-methoxypyrimidine has a molecular weight of 128.11 g/mol, XLogP of 0.62, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5-methoxypyrimidine is sourced from PubChem (CID 581840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).