1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol

C11H15BrN2O — CID 114679698

IUPAC1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol
SMILESCC1CN(c2cccc(Br)n2)CCC1O
InChIInChI=1S/C11H15BrN2O/c1-8-7-14(6-5-9(8)15)11-4-2-3-10(12)13-11/h2-4,8-9,15H,5-7H2,1H3
InChIKeyFKJMEHLODCASFT-UHFFFAOYSA-N
MW271.16 g/mol
LogP2.05
Rot. Bonds1

About 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol

1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol (PubChem CID 114679698) has the molecular formula C11H15BrN2O and a molecular weight of 271.16 g/mol. Its IUPAC name is 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol
PubChem CID114679698
Molecular FormulaC11H15BrN2O
Molecular Weight271.16 g/mol
Exact Mass270.04
IUPAC Name1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol
SMILESCC1CN(c2cccc(Br)n2)CCC1O
InChIInChI=1S/C11H15BrN2O/c1-8-7-14(6-5-9(8)15)11-4-2-3-10(12)13-11/h2-4,8-9,15H,5-7H2,1H3
InChIKeyFKJMEHLODCASFT-UHFFFAOYSA-N
XLogP2.05
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-6-(3-methylpyrrolidin-1-yl)pyridine
CID 63961516
1-(6-bromo-2-pyridinyl)azetidin-3-ol
CID 130844354
1-(6-bromo-2-pyridinyl)-3-methylpiperazine;hydrochloride
CID 71639395
1-(6-bromo-2-pyridinyl)-N,N-dimethylpiperidin-4-amine
CID 63962583
2-bromo-6-[(5S)-3,5-dimethylpiperidin-1-yl]pyridine
CID 170582340
1-(6-bromo-2-pyridinyl)-N-methylpiperidin-4-amine;hydrochloride
CID 71642777
2-bromo-6-(4-ethylpiperidin-1-yl)pyridine
CID 63963224
(2S)-4-(6-bromo-2-pyridinyl)-2,6-dimethylmorpholine
CID 87428069
1-(4-bromo-1,3-thiazol-2-yl)-3-methylpiperidin-4-ol
CID 114679675
tert-butyl (2R)-4-(6-bromo-2-pyridinyl)-2-methylpiperazine-1-carboxylate
CID 86329596
1-[1-(6-bromo-2-pyridinyl)piperidin-4-yl]-N,N-dimethylmethanamine
CID 63962807
2-bromo-6-(2,5-dimethylpyrrolidin-1-yl)pyridine
CID 151614904

Frequently Asked Questions

What is the IUPAC name of 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol?
The IUPAC name of 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol (CID 114679698) is 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol.
What is the SMILES notation for 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol?
The canonical SMILES for 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol is CC1CN(c2cccc(Br)n2)CCC1O.
What is the InChIKey of 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol?
The InChIKey is FKJMEHLODCASFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrN2O/c1-8-7-14(6-5-9(8)15)11-4-2-3-10(12)13-11/h2-4,8-9,15H,5-7H2,1H3.
What are the key properties of 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol?
1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol has a molecular weight of 271.16 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bromo-2-pyridinyl)-3-methylpiperidin-4-ol is sourced from PubChem (CID 114679698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).