2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine

C11H15BrN2O — CID 129202847

IUPAC2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine
SMILESCN1CCC(Oc2ccc(Br)nc2)CC1
InChIInChI=1S/C11H15BrN2O/c1-14-6-4-9(5-7-14)15-10-2-3-11(12)13-8-10/h2-3,8-9H,4-7H2,1H3
InChIKeyYZRQVXSQYSZSFI-UHFFFAOYSA-N
MW271.16 g/mol
LogP2.32
Rot. Bonds2

About 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine

2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine (PubChem CID 129202847) has the molecular formula C11H15BrN2O and a molecular weight of 271.16 g/mol. Its IUPAC name is 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine.

Molecular Properties

Compound Name2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine
PubChem CID129202847
Molecular FormulaC11H15BrN2O
Molecular Weight271.16 g/mol
Exact Mass270.04
IUPAC Name2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine
SMILESCN1CCC(Oc2ccc(Br)nc2)CC1
InChIInChI=1S/C11H15BrN2O/c1-14-6-4-9(5-7-14)15-10-2-3-11(12)13-8-10/h2-3,8-9H,4-7H2,1H3
InChIKeyYZRQVXSQYSZSFI-UHFFFAOYSA-N
XLogP2.32
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-(1-methylpiperidin-4-yl)oxypyridin-2-amine
CID 71565292
tert-butyl 4-[(6-bromo-3-pyridinyl)oxy]piperidine-1-carboxylate
CID 119087105
2-methyl-5-[(3S)-1-methylpyrrolidin-3-yl]oxypyridine
CID 153376594
3-(1-methylpiperidin-4-yl)oxypyridine
CID 18433351
5-(1-methylpyrrolidin-3-yl)oxypyridin-2-amine
CID 130834078
1-[5-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]propan-1-amine
CID 112584872
N'-hydroxy-5-(1-methylpiperidin-4-yl)oxypyridine-2-carboximidamide
CID 136990869
N-methyl-4-[5-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]aniline
CID 166814790
2-bromo-5-[4-(1-methylpiperidin-4-yl)oxycyclohexyl]oxypyrazine
CID 89388695
4-(1-methylpiperidin-4-yl)oxypyridine
CID 18723159
4-(4-iodophenoxy)-1-methylpiperidine
CID 86710870
5-[5-(1-methylpiperidin-4-yl)oxy-2-pyridinyl]pyridine-2,4-diamine
CID 171572533

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine?
The IUPAC name of 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine (CID 129202847) is 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine.
What is the SMILES notation for 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine?
The canonical SMILES for 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine is CN1CCC(Oc2ccc(Br)nc2)CC1.
What is the InChIKey of 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine?
The InChIKey is YZRQVXSQYSZSFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O/c1-14-6-4-9(5-7-14)15-10-2-3-11(12)13-8-10/h2-3,8-9H,4-7H2,1H3.
What are the key properties of 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine?
2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine has a molecular weight of 271.16 g/mol, XLogP of 2.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-(1-methylpiperidin-4-yl)oxypyridine is sourced from PubChem (CID 129202847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).