4-bromo-2,6-dimethylpyrimidine

C6H7BrN2 — CID 10965245

IUPAC4-bromo-2,6-dimethylpyrimidine
SMILESCc1cc(Br)nc(C)n1
InChIInChI=1S/C6H7BrN2/c1-4-3-6(7)9-5(2)8-4/h3H,1-2H3
InChIKeyPTCKNLGMBFKIFP-UHFFFAOYSA-N
MW187.04 g/mol
LogP1.86
Rot. Bonds

About 4-bromo-2,6-dimethylpyrimidine

4-bromo-2,6-dimethylpyrimidine (PubChem CID 10965245) has the molecular formula C6H7BrN2 and a molecular weight of 187.04 g/mol. Its IUPAC name is 4-bromo-2,6-dimethylpyrimidine.

Molecular Properties

Compound Name4-bromo-2,6-dimethylpyrimidine
PubChem CID10965245
Molecular FormulaC6H7BrN2
Molecular Weight187.04 g/mol
Exact Mass185.98
IUPAC Name4-bromo-2,6-dimethylpyrimidine
SMILESCc1cc(Br)nc(C)n1
InChIInChI=1S/C6H7BrN2/c1-4-3-6(7)9-5(2)8-4/h3H,1-2H3
InChIKeyPTCKNLGMBFKIFP-UHFFFAOYSA-N
XLogP1.86
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.04
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-Dimethyl-4-aminopyrimidine
CID 68039
2-Bromo-4,6-dimethylpyrimidine
CID 12758425
4-Bromo-6-methylpyrimidine
CID 45117387
2-Ethyl-6-methylpyrimidin-4-amine
CID 12494902
2,4,6-Trimethylpyrimidine
CID 817251
4-Bromo-6-methyl-2-(propan-2-yl)pyrimidine
CID 43517260
4-Bromo-2-(difluoromethyl)-6-methylpyrimidine
CID 137940646
2,4-Dibromo-6-(trifluoromethyl)pyrimidine
CID 11438181
N,N,2,6-Tetramethylpyrimidin-4-amine
CID 12415533
5-Bromo-2,6-dimethyl-4-pyrimidinamine
CID 608548
4-Bromo-2-chloro-6-methylpyrimidine
CID 66521139
4-Fluoro-2,6-dimethylpyrimidine
CID 45080335

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2,6-dimethylpyrimidine?
The IUPAC name of 4-bromo-2,6-dimethylpyrimidine (CID 10965245) is 4-bromo-2,6-dimethylpyrimidine.
What is the SMILES notation for 4-bromo-2,6-dimethylpyrimidine?
The canonical SMILES for 4-bromo-2,6-dimethylpyrimidine is Cc1cc(Br)nc(C)n1.
What is the InChIKey of 4-bromo-2,6-dimethylpyrimidine?
The InChIKey is PTCKNLGMBFKIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7BrN2/c1-4-3-6(7)9-5(2)8-4/h3H,1-2H3.
What are the key properties of 4-bromo-2,6-dimethylpyrimidine?
4-bromo-2,6-dimethylpyrimidine has a molecular weight of 187.04 g/mol, XLogP of 1.86, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2,6-dimethylpyrimidine is sourced from PubChem (CID 10965245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).