2-bromo-5-[(2R)-piperidin-2-yl]phenol

C11H14BrNO — CID 130699877

IUPAC2-bromo-5-[(2R)-piperidin-2-yl]phenol
SMILESOc1cc([C@H]2CCCCN2)ccc1Br
InChIInChI=1S/C11H14BrNO/c12-9-5-4-8(7-11(9)14)10-3-1-2-6-13-10/h4-5,7,10,13-14H,1-3,6H2/t10-/m1/s1
InChIKeyRVZJONOOSSFXMH-SNVBAGLBSA-N
MW256.14 g/mol
LogP2.97
Rot. Bonds1

About 2-bromo-5-[(2R)-piperidin-2-yl]phenol

2-bromo-5-[(2R)-piperidin-2-yl]phenol (PubChem CID 130699877) has the molecular formula C11H14BrNO and a molecular weight of 256.14 g/mol. Its IUPAC name is 2-bromo-5-[(2R)-piperidin-2-yl]phenol.

Molecular Properties

Compound Name2-bromo-5-[(2R)-piperidin-2-yl]phenol
PubChem CID130699877
Molecular FormulaC11H14BrNO
Molecular Weight256.14 g/mol
Exact Mass255.03
IUPAC Name2-bromo-5-[(2R)-piperidin-2-yl]phenol
SMILESOc1cc([C@H]2CCCCN2)ccc1Br
InChIInChI=1S/C11H14BrNO/c12-9-5-4-8(7-11(9)14)10-3-1-2-6-13-10/h4-5,7,10,13-14H,1-3,6H2/t10-/m1/s1
InChIKeyRVZJONOOSSFXMH-SNVBAGLBSA-N
XLogP2.97
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.14
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-4-[(2R)-pyrrolidin-2-yl]phenol
CID 66519672
2-bromo-4-[(2R)-pyrrolidin-2-yl]phenol;hydrochloride
CID 171195910
2-fluoro-5-[(2S)-piperidin-2-yl]phenol
CID 131076447
4-[(2S)-pyrrolidin-2-yl]benzene-1,2-diol
CID 66518287
2-iodo-4-[(2S)-piperidin-2-yl]phenol
CID 130646263
2-methyl-4-[(2R)-piperidin-2-yl]phenol
CID 131198389
2-(3-bromo-4-chlorophenyl)azepane
CID 107998182
(2S)-2-(4-bromophenyl)piperidine
CID 7022866
4-piperidin-2-ylphenol
CID 19711202
2-(4-bromo-3-iodophenyl)pyrrolidine
CID 130043760
2-methylsulfonyl-5-piperidin-2-ylphenol
CID 117391593
6-[(2R)-piperidin-2-yl]naphthalen-2-ol
CID 171195375

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-[(2R)-piperidin-2-yl]phenol?
The IUPAC name of 2-bromo-5-[(2R)-piperidin-2-yl]phenol (CID 130699877) is 2-bromo-5-[(2R)-piperidin-2-yl]phenol.
What is the SMILES notation for 2-bromo-5-[(2R)-piperidin-2-yl]phenol?
The canonical SMILES for 2-bromo-5-[(2R)-piperidin-2-yl]phenol is Oc1cc([C@H]2CCCCN2)ccc1Br.
What is the InChIKey of 2-bromo-5-[(2R)-piperidin-2-yl]phenol?
The InChIKey is RVZJONOOSSFXMH-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H14BrNO/c12-9-5-4-8(7-11(9)14)10-3-1-2-6-13-10/h4-5,7,10,13-14H,1-3,6H2/t10-/m1/s1.
What are the key properties of 2-bromo-5-[(2R)-piperidin-2-yl]phenol?
2-bromo-5-[(2R)-piperidin-2-yl]phenol has a molecular weight of 256.14 g/mol, XLogP of 2.97, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-[(2R)-piperidin-2-yl]phenol is sourced from PubChem (CID 130699877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).