6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine

C15H14BrN3O — CID 83779639

IUPAC6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine
SMILESCOc1cc(C)c(-c2cn3cc(Br)cnc3n2)cc1C
InChIInChI=1S/C15H14BrN3O/c1-9-5-14(20-3)10(2)4-12(9)13-8-19-7-11(16)6-17-15(19)18-13/h4-8H,1-3H3
InChIKeyBGMOUZJDOYXKBW-UHFFFAOYSA-N
MW332.20 g/mol
LogP3.78
Rot. Bonds2

About 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine

6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine (PubChem CID 83779639) has the molecular formula C15H14BrN3O and a molecular weight of 332.20 g/mol. Its IUPAC name is 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine
PubChem CID83779639
Molecular FormulaC15H14BrN3O
Molecular Weight332.20 g/mol
Exact Mass331.03
IUPAC Name6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine
SMILESCOc1cc(C)c(-c2cn3cc(Br)cnc3n2)cc1C
InChIInChI=1S/C15H14BrN3O/c1-9-5-14(20-3)10(2)4-12(9)13-8-19-7-11(16)6-17-15(19)18-13/h4-8H,1-3H3
InChIKeyBGMOUZJDOYXKBW-UHFFFAOYSA-N
XLogP3.78
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.20
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-bromo-2-(2,4,5-trimethylphenyl)imidazo[1,2-a]pyridine
CID 71627725
6-bromo-2-(4-methylsulfanylphenyl)imidazo[1,2-a]pyrimidine
CID 115404681
methyl 4-(6-bromoimidazo[1,2-a]pyrimidin-2-yl)benzoate
CID 45158634
3-bromo-6-(4-methoxy-2,5-dimethylphenyl)pyridazine
CID 82094372
4-(4-methoxy-2,5-dimethylphenyl)-2-methyl-1,3-thiazole
CID 82129098
6-bromo-2-(1H-pyrrol-2-yl)imidazo[1,2-a]pyrimidine
CID 115404646
6-bromo-2-[3-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrimidine
CID 115404629
4-(4-ethoxy-2,5-dimethylphenyl)imidazole-1,2-diamine
CID 82295331
2-(3,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyrimidine
CID 177180602
6-bromo-2-propylimidazo[1,2-a]pyrimidine
CID 115404624
3-bromo-6-(2-methoxy-4,5-dimethylphenyl)imidazo[1,2-b]pyridazine
CID 116854679
1,4-dimethoxy-2,5-dimethylbenzene;dihydrochloride
CID 172845974

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine (CID 83779639) is 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine is COc1cc(C)c(-c2cn3cc(Br)cnc3n2)cc1C.
What is the InChIKey of 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine?
The InChIKey is BGMOUZJDOYXKBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrN3O/c1-9-5-14(20-3)10(2)4-12(9)13-8-19-7-11(16)6-17-15(19)18-13/h4-8H,1-3H3.
What are the key properties of 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine?
6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine has a molecular weight of 332.20 g/mol, XLogP of 3.78, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(4-methoxy-2,5-dimethylphenyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 83779639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).