2,4-diethoxy-5,6-difluoropyrimidine

C8H10F2N2O2 — CID 134912746

IUPAC2,4-diethoxy-5,6-difluoropyrimidine
SMILESCCOc1nc(F)c(F)c(OCC)n1
InChIInChI=1S/C8H10F2N2O2/c1-3-13-7-5(9)6(10)11-8(12-7)14-4-2/h3-4H2,1-2H3
InChIKeyZQRCLKBHYNQNKS-UHFFFAOYSA-N
MW204.18 g/mol
LogP1.55
Rot. Bonds4

About 2,4-diethoxy-5,6-difluoropyrimidine

2,4-diethoxy-5,6-difluoropyrimidine (PubChem CID 134912746) has the molecular formula C8H10F2N2O2 and a molecular weight of 204.18 g/mol. Its IUPAC name is 2,4-diethoxy-5,6-difluoropyrimidine.

Molecular Properties

Compound Name2,4-diethoxy-5,6-difluoropyrimidine
PubChem CID134912746
Molecular FormulaC8H10F2N2O2
Molecular Weight204.18 g/mol
Exact Mass204.07
IUPAC Name2,4-diethoxy-5,6-difluoropyrimidine
SMILESCCOc1nc(F)c(F)c(OCC)n1
InChIInChI=1S/C8H10F2N2O2/c1-3-13-7-5(9)6(10)11-8(12-7)14-4-2/h3-4H2,1-2H3
InChIKeyZQRCLKBHYNQNKS-UHFFFAOYSA-N
XLogP1.55
TPSA44.24 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.18
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

CID 14717225
CID 14717225
CID 102101568
CID 102101568
CID 126478348
CID 126478348
CID 3109473
CID 3109473
CID 129785473
CID 129785473
CID 13420870
CID 13420870
CID 60096147
CID 60096147
CID 21730836
CID 21730836
CID 255393
CID 255393
CID 13061613
CID 13061613
CID 14717226
CID 14717226
CID 14717227
CID 14717227

Frequently Asked Questions

What is the IUPAC name of 2,4-diethoxy-5,6-difluoropyrimidine?
The IUPAC name of 2,4-diethoxy-5,6-difluoropyrimidine (CID 134912746) is 2,4-diethoxy-5,6-difluoropyrimidine.
What is the SMILES notation for 2,4-diethoxy-5,6-difluoropyrimidine?
The canonical SMILES for 2,4-diethoxy-5,6-difluoropyrimidine is CCOc1nc(F)c(F)c(OCC)n1.
What is the InChIKey of 2,4-diethoxy-5,6-difluoropyrimidine?
The InChIKey is ZQRCLKBHYNQNKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O2/c1-3-13-7-5(9)6(10)11-8(12-7)14-4-2/h3-4H2,1-2H3.
What are the key properties of 2,4-diethoxy-5,6-difluoropyrimidine?
2,4-diethoxy-5,6-difluoropyrimidine has a molecular weight of 204.18 g/mol, XLogP of 1.55, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-diethoxy-5,6-difluoropyrimidine is sourced from PubChem (CID 134912746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).