4-bromo-2-methyl-6-propan-2-ylpyridine

C9H12BrN — CID 91619872

IUPAC4-bromo-2-methyl-6-propan-2-ylpyridine
SMILESCc1cc(Br)cc(C(C)C)n1
InChIInChI=1S/C9H12BrN/c1-6(2)9-5-8(10)4-7(3)11-9/h4-6H,1-3H3
InChIKeyWETJWBNQVXQINP-UHFFFAOYSA-N
MW214.11 g/mol
LogP3.28
Rot. Bonds1

About 4-bromo-2-methyl-6-propan-2-ylpyridine

4-bromo-2-methyl-6-propan-2-ylpyridine (PubChem CID 91619872) has the molecular formula C9H12BrN and a molecular weight of 214.11 g/mol. Its IUPAC name is 4-bromo-2-methyl-6-propan-2-ylpyridine.

Molecular Properties

Compound Name4-bromo-2-methyl-6-propan-2-ylpyridine
PubChem CID91619872
Molecular FormulaC9H12BrN
Molecular Weight214.11 g/mol
Exact Mass213.02
IUPAC Name4-bromo-2-methyl-6-propan-2-ylpyridine
SMILESCc1cc(Br)cc(C(C)C)n1
InChIInChI=1S/C9H12BrN/c1-6(2)9-5-8(10)4-7(3)11-9/h4-6H,1-3H3
InChIKeyWETJWBNQVXQINP-UHFFFAOYSA-N
XLogP3.28
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.11
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,4-dibromo-6-propan-2-ylpyridine
CID 66520791
4-bromo-2-fluoro-3-methyl-6-propan-2-ylpyridine
CID 153298968
3-bromo-5-(4-methyl-6-propan-2-ylpyrimidin-2-yl)oxyaniline
CID 103589085
2-methyl-4-(3-methylbut-1-en-2-yl)-6-propan-2-ylpyridine
CID 91239002
4-bromo-6-methyl-2-propan-2-ylpyrimidine
CID 43517260
2-(5-bromo-2-methylphenoxy)-4-methyl-6-propan-2-ylpyrimidine
CID 107284442
2-methyl-6-propan-2-ylpyridine
CID 12791785
2-(4-methyl-6-propan-2-ylpyrimidin-2-yl)ethanol
CID 116893893
2,3,4-trimethyl-6-propan-2-ylpyridine
CID 20745705
4-chloro-2-(2,6-dimethyl-4-pyridinyl)-6-propan-2-ylpyrimidine
CID 107502262
2-(2-bromo-4-fluorophenoxy)-4-methyl-6-propan-2-ylpyrimidine
CID 113491450
4-methyl-6-propan-2-yl-2-propoxypyrimidine
CID 176993586

Frequently Asked Questions

What is the IUPAC name of 4-bromo-2-methyl-6-propan-2-ylpyridine?
The IUPAC name of 4-bromo-2-methyl-6-propan-2-ylpyridine (CID 91619872) is 4-bromo-2-methyl-6-propan-2-ylpyridine.
What is the SMILES notation for 4-bromo-2-methyl-6-propan-2-ylpyridine?
The canonical SMILES for 4-bromo-2-methyl-6-propan-2-ylpyridine is Cc1cc(Br)cc(C(C)C)n1.
What is the InChIKey of 4-bromo-2-methyl-6-propan-2-ylpyridine?
The InChIKey is WETJWBNQVXQINP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12BrN/c1-6(2)9-5-8(10)4-7(3)11-9/h4-6H,1-3H3.
What are the key properties of 4-bromo-2-methyl-6-propan-2-ylpyridine?
4-bromo-2-methyl-6-propan-2-ylpyridine has a molecular weight of 214.11 g/mol, XLogP of 3.28, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-2-methyl-6-propan-2-ylpyridine is sourced from PubChem (CID 91619872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).