[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol

C11H14BrClN2O — CID 114836463

IUPAC[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol
SMILESOCC1CCCCN1c1ncc(Cl)cc1Br
InChIInChI=1S/C11H14BrClN2O/c12-10-5-8(13)6-14-11(10)15-4-2-1-3-9(15)7-16/h5-6,9,16H,1-4,7H2
InChIKeySZGASWAIAXWXBO-UHFFFAOYSA-N
MW305.60 g/mol
LogP2.85
Rot. Bonds2

About [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol

[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol (PubChem CID 114836463) has the molecular formula C11H14BrClN2O and a molecular weight of 305.60 g/mol. Its IUPAC name is [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol
PubChem CID114836463
Molecular FormulaC11H14BrClN2O
Molecular Weight305.60 g/mol
Exact Mass304.00
IUPAC Name[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol
SMILESOCC1CCCCN1c1ncc(Cl)cc1Br
InChIInChI=1S/C11H14BrClN2O/c12-10-5-8(13)6-14-11(10)15-4-2-1-3-9(15)7-16/h5-6,9,16H,1-4,7H2
InChIKeySZGASWAIAXWXBO-UHFFFAOYSA-N
XLogP2.85
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.60
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(5-chloro-3-fluoro-2-pyridinyl)piperidin-2-yl]methanol
CID 79727255
1-[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]propan-2-ol
CID 112748394
[1-(5-chloro-3-fluoro-2-pyridinyl)pyrrolidin-2-yl]methanol
CID 79727661
[1-(3-bromo-5-nitro-2-pyridinyl)piperidin-2-yl]methanol
CID 79523718
1-(3-bromo-5-chloro-2-pyridinyl)piperidine-2-carbaldehyde
CID 114838370
2-(chloromethyl)-1-(3,5-dibromo-2-pyridinyl)azepane
CID 116638871
[1-[3-chloro-5-(hydroxymethyl)-2-pyridinyl]azepan-2-yl]methanol
CID 116637093
2-(chloromethyl)-1-(3,5-dichloro-2-pyridinyl)azepane
CID 116638899
[1-(3,5-diamino-2-pyridinyl)piperidin-2-yl]methanol
CID 23064302
[1-[5-chloro-3-(3-methylsulfonylphenyl)-2-pyridinyl]piperidin-2-yl]methanol
CID 19594574
[(2S)-1-[5-chloro-3-(4-methylsulfonylphenyl)-2-pyridinyl]pyrrolidin-2-yl]methanol
CID 57023316
[1-(5-bromo-4-methoxypyrimidin-2-yl)piperidin-2-yl]methanol
CID 106998436

Frequently Asked Questions

What is the IUPAC name of [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol?
The IUPAC name of [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol (CID 114836463) is [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol.
What is the SMILES notation for [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol?
The canonical SMILES for [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol is OCC1CCCCN1c1ncc(Cl)cc1Br.
What is the InChIKey of [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol?
The InChIKey is SZGASWAIAXWXBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrClN2O/c12-10-5-8(13)6-14-11(10)15-4-2-1-3-9(15)7-16/h5-6,9,16H,1-4,7H2.
What are the key properties of [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol?
[1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol has a molecular weight of 305.60 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-bromo-5-chloro-2-pyridinyl)piperidin-2-yl]methanol is sourced from PubChem (CID 114836463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).