2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine

C7H4F2N4 — CID 22324127

IUPAC2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine
SMILESFc1cc(-c2ncc[nH]2)nc(F)n1
InChIInChI=1S/C7H4F2N4/c8-5-3-4(12-7(9)13-5)6-10-1-2-11-6/h1-3H,(H,10,11)
InChIKeyMSRYWIFSLGTUTC-UHFFFAOYSA-N
MW182.13 g/mol
LogP1.14
Rot. Bonds1

About 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine

2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine (PubChem CID 22324127) has the molecular formula C7H4F2N4 and a molecular weight of 182.13 g/mol. Its IUPAC name is 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine.

Molecular Properties

Compound Name2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine
PubChem CID22324127
Molecular FormulaC7H4F2N4
Molecular Weight182.13 g/mol
Exact Mass182.04
IUPAC Name2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine
SMILESFc1cc(-c2ncc[nH]2)nc(F)n1
InChIInChI=1S/C7H4F2N4/c8-5-3-4(12-7(9)13-5)6-10-1-2-11-6/h1-3H,(H,10,11)
InChIKeyMSRYWIFSLGTUTC-UHFFFAOYSA-N
XLogP1.14
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.13
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine?
The IUPAC name of 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine (CID 22324127) is 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine.
What is the SMILES notation for 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine?
The canonical SMILES for 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine is Fc1cc(-c2ncc[nH]2)nc(F)n1.
What is the InChIKey of 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine?
The InChIKey is MSRYWIFSLGTUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F2N4/c8-5-3-4(12-7(9)13-5)6-10-1-2-11-6/h1-3H,(H,10,11).
What are the key properties of 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine?
2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine has a molecular weight of 182.13 g/mol, XLogP of 1.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-6-(1H-imidazol-2-yl)pyrimidine is sourced from PubChem (CID 22324127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).