2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine

C12H7F2N3 — CID 113303129

IUPAC2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine
SMILESFc1cc(F)cc(-c2cn3cccnc3n2)c1
InChIInChI=1S/C12H7F2N3/c13-9-4-8(5-10(14)6-9)11-7-17-3-1-2-15-12(17)16-11/h1-7H
InChIKeyRTSUIZCDGXZKCQ-UHFFFAOYSA-N
MW231.21 g/mol
LogP2.67
Rot. Bonds1

About 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine

2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine (PubChem CID 113303129) has the molecular formula C12H7F2N3 and a molecular weight of 231.21 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine
PubChem CID113303129
Molecular FormulaC12H7F2N3
Molecular Weight231.21 g/mol
Exact Mass231.06
IUPAC Name2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine
SMILESFc1cc(F)cc(-c2cn3cccnc3n2)c1
InChIInChI=1S/C12H7F2N3/c13-9-4-8(5-10(14)6-9)11-7-17-3-1-2-15-12(17)16-11/h1-7H
InChIKeyRTSUIZCDGXZKCQ-UHFFFAOYSA-N
XLogP2.67
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.21
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-bromophenyl)imidazo[1,2-a]pyrimidine
CID 14913301
2-pyridin-3-ylimidazo[1,2-a]pyrimidine
CID 10035574
2-pyridin-2-ylimidazo[1,2-a]pyrimidine
CID 70500058
3,5-difluoro-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methoxyphenyl)benzenesulfonamide
CID 122285550
3-fluoro-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzamide
CID 7080166
2-(1-ethylpyrazol-4-yl)imidazo[1,2-a]pyrimidine
CID 115403490
2-(3-bromo-4-methoxyphenyl)imidazo[1,2-a]pyrimidine
CID 696188
2,6-difluoro-N-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)benzenesulfonamide
CID 122285192
4-fluoro-N-(5-imidazo[1,2-a]pyrimidin-2-yl-2-methylphenyl)benzenesulfonamide
CID 22581302
6-(3,5-difluorophenyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyrimidine
CID 69411832
2-(4-bromothiophen-2-yl)imidazo[1,2-a]pyrimidine
CID 107355573
1-(3,4-difluorophenyl)-3-(3-imidazo[1,2-a]pyrimidin-2-ylphenyl)urea
CID 122285057

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine (CID 113303129) is 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine is Fc1cc(F)cc(-c2cn3cccnc3n2)c1.
What is the InChIKey of 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine?
The InChIKey is RTSUIZCDGXZKCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F2N3/c13-9-4-8(5-10(14)6-9)11-7-17-3-1-2-15-12(17)16-11/h1-7H.
What are the key properties of 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine?
2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine has a molecular weight of 231.21 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 113303129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).