1-(3-bromo-4-pyridinyl)piperidin-4-ol

C10H13BrN2O — CID 104777750

IUPAC1-(3-bromo-4-pyridinyl)piperidin-4-ol
SMILESOC1CCN(c2ccncc2Br)CC1
InChIInChI=1S/C10H13BrN2O/c11-9-7-12-4-1-10(9)13-5-2-8(14)3-6-13/h1,4,7-8,14H,2-3,5-6H2
InChIKeyUSYYETSTGPCQOG-UHFFFAOYSA-N
MW257.13 g/mol
LogP1.81
Rot. Bonds1

About 1-(3-bromo-4-pyridinyl)piperidin-4-ol

1-(3-bromo-4-pyridinyl)piperidin-4-ol (PubChem CID 104777750) has the molecular formula C10H13BrN2O and a molecular weight of 257.13 g/mol. Its IUPAC name is 1-(3-bromo-4-pyridinyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(3-bromo-4-pyridinyl)piperidin-4-ol
PubChem CID104777750
Molecular FormulaC10H13BrN2O
Molecular Weight257.13 g/mol
Exact Mass256.02
IUPAC Name1-(3-bromo-4-pyridinyl)piperidin-4-ol
SMILESOC1CCN(c2ccncc2Br)CC1
InChIInChI=1S/C10H13BrN2O/c11-9-7-12-4-1-10(9)13-5-2-8(14)3-6-13/h1,4,7-8,14H,2-3,5-6H2
InChIKeyUSYYETSTGPCQOG-UHFFFAOYSA-N
XLogP1.81
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.13
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-4-(4-methoxypiperidin-1-yl)pyridine
CID 104778046
(3aR,8aS)-6-(3-bromo-4-pyridinyl)-2,3,3a,4,5,7,8,8a-octahydro-1H-pyrrolo[3,4-d]azepine
CID 128843555
(3S)-1-(3-bromo-4-pyridinyl)pyrrolidin-3-amine
CID 124595065
4-(4-benzylpiperidin-1-yl)-3-bromopyridine
CID 104778025
1-(3-bromo-4-pyridinyl)-N,N-dimethylazepan-4-amine
CID 163374943
1-(3-bromo-4-pyridinyl)-N-cyclopropylpiperidine-4-carboxamide
CID 163343619
N-[[1-(3-bromo-4-pyridinyl)piperidin-4-yl]methyl]propan-1-amine
CID 104779258
N-[1-(3-bromo-4-pyridinyl)piperidin-4-yl]pyridine-4-carboxamide
CID 172901933
1-(3-bromo-4-pyridinyl)piperidin-2-ol
CID 130114596
2-[1-(3-bromo-4-pyridinyl)piperidin-4-yl]-N-methylethanamine
CID 113452072
3-bromo-4-(4-chloro-3-methylpiperidin-1-yl)pyridine
CID 114682648
1-(3-bromo-4-pyridinyl)-4-(2,3-dimethylphenyl)piperazine
CID 104777973

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromo-4-pyridinyl)piperidin-4-ol?
The IUPAC name of 1-(3-bromo-4-pyridinyl)piperidin-4-ol (CID 104777750) is 1-(3-bromo-4-pyridinyl)piperidin-4-ol.
What is the SMILES notation for 1-(3-bromo-4-pyridinyl)piperidin-4-ol?
The canonical SMILES for 1-(3-bromo-4-pyridinyl)piperidin-4-ol is OC1CCN(c2ccncc2Br)CC1.
What is the InChIKey of 1-(3-bromo-4-pyridinyl)piperidin-4-ol?
The InChIKey is USYYETSTGPCQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O/c11-9-7-12-4-1-10(9)13-5-2-8(14)3-6-13/h1,4,7-8,14H,2-3,5-6H2.
What are the key properties of 1-(3-bromo-4-pyridinyl)piperidin-4-ol?
1-(3-bromo-4-pyridinyl)piperidin-4-ol has a molecular weight of 257.13 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromo-4-pyridinyl)piperidin-4-ol is sourced from PubChem (CID 104777750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).