2-(2-bromophenyl)piperidin-3-ol;hydrochloride

C11H15BrClNO — CID 115052990

IUPAC2-(2-bromophenyl)piperidin-3-ol;hydrochloride
SMILESCl.OC1CCCNC1c1ccccc1Br
InChIInChI=1S/C11H14BrNO.ClH/c12-9-5-2-1-4-8(9)11-10(14)6-3-7-13-11;/h1-2,4-5,10-11,13-14H,3,6-7H2;1H
InChIKeyORFANIZGXMNHRF-UHFFFAOYSA-N
MW292.60 g/mol
LogP2.66
Rot. Bonds1

About 2-(2-bromophenyl)piperidin-3-ol;hydrochloride

2-(2-bromophenyl)piperidin-3-ol;hydrochloride (PubChem CID 115052990) has the molecular formula C11H15BrClNO and a molecular weight of 292.60 g/mol. Its IUPAC name is 2-(2-bromophenyl)piperidin-3-ol;hydrochloride.

Molecular Properties

Compound Name2-(2-bromophenyl)piperidin-3-ol;hydrochloride
PubChem CID115052990
Molecular FormulaC11H15BrClNO
Molecular Weight292.60 g/mol
Exact Mass291.00
IUPAC Name2-(2-bromophenyl)piperidin-3-ol;hydrochloride
SMILESCl.OC1CCCNC1c1ccccc1Br
InChIInChI=1S/C11H14BrNO.ClH/c12-9-5-2-1-4-8(9)11-10(14)6-3-7-13-11;/h1-2,4-5,10-11,13-14H,3,6-7H2;1H
InChIKeyORFANIZGXMNHRF-UHFFFAOYSA-N
XLogP2.66
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.60
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-methylphenyl)piperidin-3-ol
CID 82403237
2-phenylpiperidin-3-ol
CID 18782643
2-bromo-6-[(2S)-pyrrolidin-2-yl]phenol
CID 66519675
2-(2-bromophenyl)imidazolidine
CID 10331308
(2S)-2-(2,3-dibromophenyl)pyrrolidine
CID 131217135
(3R)-3-(2-bromophenyl)pyrrolidine
CID 95447261
3-(2-bromophenyl)-1,4-thiazepane
CID 66219747
2-(2-bromophenyl)-1,3-oxazinane
CID 82293281
2-(2-bromophenyl)pyrrolidin-3-one;hydrochloride
CID 115051098
2-(2-bromophenyl)-3,3-difluoropiperidine
CID 84730265
[(2S,3S)-3-(2-bromophenyl)pyrrolidin-2-yl]methanol
CID 131001241
(2R,3S)-3-(2-bromophenyl)pyrrolidine-2-carboxylic acid
CID 131873357

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)piperidin-3-ol;hydrochloride?
The IUPAC name of 2-(2-bromophenyl)piperidin-3-ol;hydrochloride (CID 115052990) is 2-(2-bromophenyl)piperidin-3-ol;hydrochloride.
What is the SMILES notation for 2-(2-bromophenyl)piperidin-3-ol;hydrochloride?
The canonical SMILES for 2-(2-bromophenyl)piperidin-3-ol;hydrochloride is Cl.OC1CCCNC1c1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)piperidin-3-ol;hydrochloride?
The InChIKey is ORFANIZGXMNHRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14BrNO.ClH/c12-9-5-2-1-4-8(9)11-10(14)6-3-7-13-11;/h1-2,4-5,10-11,13-14H,3,6-7H2;1H.
What are the key properties of 2-(2-bromophenyl)piperidin-3-ol;hydrochloride?
2-(2-bromophenyl)piperidin-3-ol;hydrochloride has a molecular weight of 292.60 g/mol, XLogP of 2.66, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)piperidin-3-ol;hydrochloride is sourced from PubChem (CID 115052990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).