2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine

C14H18BrN — CID 144941249

IUPAC2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine
SMILESC=Cc1ccc(C(C)C(C)C)nc1C(=C)Br
InChIInChI=1S/C14H18BrN/c1-6-12-7-8-13(10(4)9(2)3)16-14(12)11(5)15/h6-10H,1,5H2,2-4H3
InChIKeyNQPUIJGOBHLJFN-UHFFFAOYSA-N
MW280.21 g/mol
LogP4.85
Rot. Bonds4

About 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine

2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine (PubChem CID 144941249) has the molecular formula C14H18BrN and a molecular weight of 280.21 g/mol. Its IUPAC name is 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine.

Molecular Properties

Compound Name2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine
PubChem CID144941249
Molecular FormulaC14H18BrN
Molecular Weight280.21 g/mol
Exact Mass279.06
IUPAC Name2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine
SMILESC=Cc1ccc(C(C)C(C)C)nc1C(=C)Br
InChIInChI=1S/C14H18BrN/c1-6-12-7-8-13(10(4)9(2)3)16-14(12)11(5)15/h6-10H,1,5H2,2-4H3
InChIKeyNQPUIJGOBHLJFN-UHFFFAOYSA-N
XLogP4.85
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.21
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-butan-2-yl-3-ethenyl-2-(1-fluoroethenyl)pyridine
CID 144941228
8-(1-bromoethenyl)-7-ethenylquinoline
CID 144820073
ethane;3-ethenyl-5-methyl-2-prop-1-en-2-ylquinoline
CID 143617144
5-chloro-2-(3-methylbutan-2-yl)quinoline
CID 144941116
1-(bromomethyl)-2-ethenylbenzene;2-methylprop-1-ene
CID 22617263
2-fluoro-6-(3-methylbutan-2-yl)pyridine
CID 164552856
ethane;3-ethenyl-2-(3-methylbut-1-en-2-yl)-1H-pyrrole
CID 171807389
1-(6-chloro-4-ethenyl-5-methoxy-2-pyridinyl)ethanol
CID 18799939
2,3-dimethylbutyl N-(5-ethenyl-6-methyl-2-pyridinyl)carbamate;ethane
CID 142525456
2,3-bis(ethenyl)naphthalene;ethane
CID 142152066
1,4-bis(ethenyl)-2,3-dimethylbenzene;dihydrate
CID 134586687
4-(1-bromoethenyl)-5-ethenyl-1,3-thiazol-2-amine
CID 145443882

Frequently Asked Questions

What is the IUPAC name of 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine?
The IUPAC name of 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine (CID 144941249) is 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine.
What is the SMILES notation for 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine?
The canonical SMILES for 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine is C=Cc1ccc(C(C)C(C)C)nc1C(=C)Br.
What is the InChIKey of 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine?
The InChIKey is NQPUIJGOBHLJFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18BrN/c1-6-12-7-8-13(10(4)9(2)3)16-14(12)11(5)15/h6-10H,1,5H2,2-4H3.
What are the key properties of 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine?
2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine has a molecular weight of 280.21 g/mol, XLogP of 4.85, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-bromoethenyl)-3-ethenyl-6-(3-methylbutan-2-yl)pyridine is sourced from PubChem (CID 144941249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).