5-bromo-2-(3-chloropentyl)pyridine

C10H13BrClN — CID 104810095

IUPAC5-bromo-2-(3-chloropentyl)pyridine
SMILESCCC(Cl)CCc1ccc(Br)cn1
InChIInChI=1S/C10H13BrClN/c1-2-9(12)4-6-10-5-3-8(11)7-13-10/h3,5,7,9H,2,4,6H2,1H3
InChIKeyLHMMOSXDXOPMPS-UHFFFAOYSA-N
MW262.58 g/mol
LogP3.79
Rot. Bonds4

About 5-bromo-2-(3-chloropentyl)pyridine

5-bromo-2-(3-chloropentyl)pyridine (PubChem CID 104810095) has the molecular formula C10H13BrClN and a molecular weight of 262.58 g/mol. Its IUPAC name is 5-bromo-2-(3-chloropentyl)pyridine.

Molecular Properties

Compound Name5-bromo-2-(3-chloropentyl)pyridine
PubChem CID104810095
Molecular FormulaC10H13BrClN
Molecular Weight262.58 g/mol
Exact Mass260.99
IUPAC Name5-bromo-2-(3-chloropentyl)pyridine
SMILESCCC(Cl)CCc1ccc(Br)cn1
InChIInChI=1S/C10H13BrClN/c1-2-9(12)4-6-10-5-3-8(11)7-13-10/h3,5,7,9H,2,4,6H2,1H3
InChIKeyLHMMOSXDXOPMPS-UHFFFAOYSA-N
XLogP3.79
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.58
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

5-bromo-2-(3-bromopentyl)pyridine
CID 104810136
5-bromo-2-(4-chloroheptyl)pyridine
CID 104812176
5-bromo-2-(3-bromohexyl)pyridine
CID 104810132
4-(5-bromo-2-pyridinyl)-N-propylbutan-2-amine
CID 104799854
4-(5-bromo-2-pyridinyl)-N-ethyl-2-methylbutan-1-amine
CID 104812047
1-(5-bromo-2-pyridinyl)-3-methylpentan-2-ol
CID 104800109
5-bromo-2-[2-(chloromethyl)pentyl]pyridine
CID 104813262
6-(5-bromo-2-pyridinyl)-N-ethyl-2-methylhexan-3-amine
CID 104812013
N-[(5-bromo-2-pyridinyl)methyl]-2-chloropropan-1-amine
CID 104811160
1-(5-bromo-2-pyridinyl)hexane-2,3-diol
CID 103454775
1-(5-bromo-2-pyridinyl)-2-methylpentan-3-ol
CID 104810070
3-(5-bromo-2-pyridinyl)-N-propan-2-ylpropan-1-amine
CID 104810396

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-(3-chloropentyl)pyridine?
The IUPAC name of 5-bromo-2-(3-chloropentyl)pyridine (CID 104810095) is 5-bromo-2-(3-chloropentyl)pyridine.
What is the SMILES notation for 5-bromo-2-(3-chloropentyl)pyridine?
The canonical SMILES for 5-bromo-2-(3-chloropentyl)pyridine is CCC(Cl)CCc1ccc(Br)cn1.
What is the InChIKey of 5-bromo-2-(3-chloropentyl)pyridine?
The InChIKey is LHMMOSXDXOPMPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrClN/c1-2-9(12)4-6-10-5-3-8(11)7-13-10/h3,5,7,9H,2,4,6H2,1H3.
What are the key properties of 5-bromo-2-(3-chloropentyl)pyridine?
5-bromo-2-(3-chloropentyl)pyridine has a molecular weight of 262.58 g/mol, XLogP of 3.79, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-(3-chloropentyl)pyridine is sourced from PubChem (CID 104810095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).