4-fluoro-2,6-dimethoxypyrimidine

C6H7FN2O2 — CID 594067

IUPAC4-fluoro-2,6-dimethoxypyrimidine
SMILESCOc1cc(F)nc(OC)n1
InChIInChI=1S/C6H7FN2O2/c1-10-5-3-4(7)8-6(9-5)11-2/h3H,1-2H3
InChIKeyYBMDMEPRJDUZMI-UHFFFAOYSA-N
MW158.13 g/mol
LogP0.63
Rot. Bonds2

About 4-fluoro-2,6-dimethoxypyrimidine

4-fluoro-2,6-dimethoxypyrimidine (PubChem CID 594067) has the molecular formula C6H7FN2O2 and a molecular weight of 158.13 g/mol. Its IUPAC name is 4-fluoro-2,6-dimethoxypyrimidine.

Molecular Properties

Compound Name4-fluoro-2,6-dimethoxypyrimidine
PubChem CID594067
Molecular FormulaC6H7FN2O2
Molecular Weight158.13 g/mol
Exact Mass158.05
IUPAC Name4-fluoro-2,6-dimethoxypyrimidine
SMILESCOc1cc(F)nc(OC)n1
InChIInChI=1S/C6H7FN2O2/c1-10-5-3-4(7)8-6(9-5)11-2/h3H,1-2H3
InChIKeyYBMDMEPRJDUZMI-UHFFFAOYSA-N
XLogP0.63
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.13
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-4,6-dimethoxypyrimidine
CID 118946
2-Pyrimidinamine, 4-chloro-6-methoxy-
CID 79811
2,6-Dimethoxy-4-aminopyrimidine
CID 76789
4,6-Dimethoxy-2-pyrimidinyl urea
CID 9837373
2,4-Dimethoxypyrimidine
CID 137976
4-Chloro-2,6-dimethoxypyrimidine
CID 80600
4-Amino-6-methoxypyrimidine
CID 735731
2,4,6-Trimethoxypyrimidine
CID 726938
2-Chloro-4,6-dimethoxypyrimidine
CID 5152323
4,6-Dimethoxypyrimidine-2-carbonitrile
CID 21466113
2,4-Diamino-6-methoxypyrimidine
CID 816925
2,4-Dichloro-6-methoxypyrimidine
CID 3824509

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2,6-dimethoxypyrimidine?
The IUPAC name of 4-fluoro-2,6-dimethoxypyrimidine (CID 594067) is 4-fluoro-2,6-dimethoxypyrimidine.
What is the SMILES notation for 4-fluoro-2,6-dimethoxypyrimidine?
The canonical SMILES for 4-fluoro-2,6-dimethoxypyrimidine is COc1cc(F)nc(OC)n1.
What is the InChIKey of 4-fluoro-2,6-dimethoxypyrimidine?
The InChIKey is YBMDMEPRJDUZMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2O2/c1-10-5-3-4(7)8-6(9-5)11-2/h3H,1-2H3.
What are the key properties of 4-fluoro-2,6-dimethoxypyrimidine?
4-fluoro-2,6-dimethoxypyrimidine has a molecular weight of 158.13 g/mol, XLogP of 0.63, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2,6-dimethoxypyrimidine is sourced from PubChem (CID 594067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).