4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine

C11H8F2N2 — CID 164652124

IUPAC4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine
SMILESFc1ccc(Cc2nccc(F)n2)cc1
InChIInChI=1S/C11H8F2N2/c12-9-3-1-8(2-4-9)7-11-14-6-5-10(13)15-11/h1-6H,7H2
InChIKeyWZRGJBWDCPKTFS-UHFFFAOYSA-N
MW206.20 g/mol
LogP2.35
Rot. Bonds2

About 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine

4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine (PubChem CID 164652124) has the molecular formula C11H8F2N2 and a molecular weight of 206.20 g/mol. Its IUPAC name is 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine.

Molecular Properties

Compound Name4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine
PubChem CID164652124
Molecular FormulaC11H8F2N2
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine
SMILESFc1ccc(Cc2nccc(F)n2)cc1
InChIInChI=1S/C11H8F2N2/c12-9-3-1-8(2-4-9)7-11-14-6-5-10(13)15-11/h1-6H,7H2
InChIKeyWZRGJBWDCPKTFS-UHFFFAOYSA-N
XLogP2.35
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(4-fluorophenyl)methyl]-1,2,4-oxadiazole
CID 54362686
[2-[(4-fluorophenyl)methyl]pyrimidin-5-yl]methanol
CID 62757349
2-[(4-fluorophenyl)methyl]-4-propan-2-ylpyrimidin-5-amine
CID 114207196
4-[4-[(5-chloro-3-pyridinyl)oxy]piperidin-1-yl]-2-[(4-fluorophenyl)methyl]pyrimidine
CID 167960842
2-[(4-fluorophenyl)methyl]-1H-pyrimidin-6-one
CID 43654591
2-[(4-ethylphenyl)methyl]pyrimidin-4-amine
CID 82284409
2,4-dibenzylpyrimidine
CID 59375877
4-chloro-2-[(3-fluorophenyl)methyl]pyrimidine
CID 61219333
2-[(2-benzylpyrimidin-4-yl)amino]-2-(4-fluorophenyl)acetamide
CID 133476327
1-[2-[(4-fluorophenyl)methyl]-4,6-dimethylpyrimidin-5-yl]-N-methylmethanamine
CID 62744269
4,6-dichloro-2-[(4-fluorophenyl)methyl]-5-propylpyrimidine
CID 63611318
2-[(4-fluorophenyl)methyl]-9-propan-2-yl-8-pyrazol-1-ylpurine
CID 150462556

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine?
The IUPAC name of 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine (CID 164652124) is 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine.
What is the SMILES notation for 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine?
The canonical SMILES for 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine is Fc1ccc(Cc2nccc(F)n2)cc1.
What is the InChIKey of 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine?
The InChIKey is WZRGJBWDCPKTFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F2N2/c12-9-3-1-8(2-4-9)7-11-14-6-5-10(13)15-11/h1-6H,7H2.
What are the key properties of 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine?
4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine has a molecular weight of 206.20 g/mol, XLogP of 2.35, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-2-[(4-fluorophenyl)methyl]pyrimidine is sourced from PubChem (CID 164652124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).