4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine

C11H8BrFN2 — CID 121205690

IUPAC4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine
SMILESFc1ccccc1Cc1cc(Br)ncn1
InChIInChI=1S/C11H8BrFN2/c12-11-6-9(14-7-15-11)5-8-3-1-2-4-10(8)13/h1-4,6-7H,5H2
InChIKeyWGPJAUSFOGLKTN-UHFFFAOYSA-N
MW267.10 g/mol
LogP2.97
Rot. Bonds2

About 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine

4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine (PubChem CID 121205690) has the molecular formula C11H8BrFN2 and a molecular weight of 267.10 g/mol. Its IUPAC name is 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine.

Molecular Properties

Compound Name4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine
PubChem CID121205690
Molecular FormulaC11H8BrFN2
Molecular Weight267.10 g/mol
Exact Mass265.99
IUPAC Name4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine
SMILESFc1ccccc1Cc1cc(Br)ncn1
InChIInChI=1S/C11H8BrFN2/c12-11-6-9(14-7-15-11)5-8-3-1-2-4-10(8)13/h1-4,6-7H,5H2
InChIKeyWGPJAUSFOGLKTN-UHFFFAOYSA-N
XLogP2.97
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.10
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-6-[(2-fluorophenyl)methyl]pyridine
CID 86652414
2-bromo-4-[(2-fluorophenyl)methyl]pyrimidine
CID 117224480
7-bromo-3-[(2-fluorophenyl)methyl]imidazo[1,5-a]pyridine
CID 117144523
2-bromo-5-[(2-fluorophenyl)methyl]-1,3,4-oxadiazole
CID 114771364
5-bromo-2-[(2-fluorophenyl)methyl]pyrimidin-4-amine
CID 66301820
1-[4-[(2-fluorophenyl)methyl]-6-methoxypyrimidin-2-yl]ethanamine
CID 82666098
4-N-(4-bromophenyl)-6-N-[2-(2-fluorophenyl)ethyl]pyrimidine-4,6-diamine
CID 112861329
4-[(2-fluorophenyl)methyl]pyridine
CID 23294432
3-[(2-fluorophenyl)methyl]-1-methylpyrazole-5-carbaldehyde
CID 115093064
8-bromo-2-[(2-fluorophenyl)methyl]imidazo[1,2-a]pyridine
CID 117137365
N-[2-(2-fluorophenyl)ethyl]-6-propan-2-ylpyrimidin-4-amine
CID 61239779
2-bromo-5-[(2-fluorophenyl)methoxy]pyridine
CID 59596668

Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine?
The IUPAC name of 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine (CID 121205690) is 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine.
What is the SMILES notation for 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine?
The canonical SMILES for 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine is Fc1ccccc1Cc1cc(Br)ncn1.
What is the InChIKey of 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine?
The InChIKey is WGPJAUSFOGLKTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrFN2/c12-11-6-9(14-7-15-11)5-8-3-1-2-4-10(8)13/h1-4,6-7H,5H2.
What are the key properties of 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine?
4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine has a molecular weight of 267.10 g/mol, XLogP of 2.97, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-[(2-fluorophenyl)methyl]pyrimidine is sourced from PubChem (CID 121205690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).