2-ethoxy-4,5-difluoro-6-methoxypyrimidine

C7H8F2N2O2 — CID 66959661

IUPAC2-ethoxy-4,5-difluoro-6-methoxypyrimidine
SMILESCCOc1nc(F)c(F)c(OC)n1
InChIInChI=1S/C7H8F2N2O2/c1-3-13-7-10-5(9)4(8)6(11-7)12-2/h3H2,1-2H3
InChIKeyUIGLYDBMBSKBGO-UHFFFAOYSA-N
MW190.15 g/mol
LogP1.16
Rot. Bonds3

About 2-ethoxy-4,5-difluoro-6-methoxypyrimidine

2-ethoxy-4,5-difluoro-6-methoxypyrimidine (PubChem CID 66959661) has the molecular formula C7H8F2N2O2 and a molecular weight of 190.15 g/mol. Its IUPAC name is 2-ethoxy-4,5-difluoro-6-methoxypyrimidine.

Molecular Properties

Compound Name2-ethoxy-4,5-difluoro-6-methoxypyrimidine
PubChem CID66959661
Molecular FormulaC7H8F2N2O2
Molecular Weight190.15 g/mol
Exact Mass190.06
IUPAC Name2-ethoxy-4,5-difluoro-6-methoxypyrimidine
SMILESCCOc1nc(F)c(F)c(OC)n1
InChIInChI=1S/C7H8F2N2O2/c1-3-13-7-10-5(9)4(8)6(11-7)12-2/h3H2,1-2H3
InChIKeyUIGLYDBMBSKBGO-UHFFFAOYSA-N
XLogP1.16
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.15
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-6-fluoro-4-methoxypyrimidine
CID 759140
4-Fluoro-2,6-dimethoxypyrimidine
CID 594067
4-Fluoro-6-methoxy-2-methyl-5-(trifluoromethyl)pyrimidine
CID 13379302
4-Ethoxy-6-fluoropyrimidin-2-amine
CID 14717225
2,4,6-Trimethoxy-5-(trifluoromethyl)pyrimidine
CID 102101568
4-Fluoro-2,6-dimethoxy-5-methylpyrimidine
CID 126478348
5-Chloro-2,4-difluoro-6-methoxypyrimidine
CID 13630770
2,4-Diethoxy-5,6-difluoropyrimidine
CID 134912746
2,4,6-Trimethoxy-5-methylpyrimidine
CID 13420870
6-Methoxy-2-methyl-5-(trifluoromethyl)pyrimidin-4-amine
CID 13379306
5-Fluoro-4-iodo-2,6-dimethoxypyrimidine
CID 21730836
2,4-Difluoro-6-methoxypyrimidine
CID 11126403

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-4,5-difluoro-6-methoxypyrimidine?
The IUPAC name of 2-ethoxy-4,5-difluoro-6-methoxypyrimidine (CID 66959661) is 2-ethoxy-4,5-difluoro-6-methoxypyrimidine.
What is the SMILES notation for 2-ethoxy-4,5-difluoro-6-methoxypyrimidine?
The canonical SMILES for 2-ethoxy-4,5-difluoro-6-methoxypyrimidine is CCOc1nc(F)c(F)c(OC)n1.
What is the InChIKey of 2-ethoxy-4,5-difluoro-6-methoxypyrimidine?
The InChIKey is UIGLYDBMBSKBGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O2/c1-3-13-7-10-5(9)4(8)6(11-7)12-2/h3H2,1-2H3.
What are the key properties of 2-ethoxy-4,5-difluoro-6-methoxypyrimidine?
2-ethoxy-4,5-difluoro-6-methoxypyrimidine has a molecular weight of 190.15 g/mol, XLogP of 1.16, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-4,5-difluoro-6-methoxypyrimidine is sourced from PubChem (CID 66959661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).