(2R)-2-(5-bromothiophen-2-yl)piperidine

C9H12BrNS — CID 7048175

IUPAC(2R)-2-(5-bromothiophen-2-yl)piperidine
SMILESBrc1ccc([C@H]2CCCCN2)s1
InChIInChI=1S/C9H12BrNS/c10-9-5-4-8(12-9)7-3-1-2-6-11-7/h4-5,7,11H,1-3,6H2/t7-/m1/s1
InChIKeyURXSDDBKOOFFJD-SSDOTTSWSA-N
MW246.17 g/mol
LogP3.33
Rot. Bonds1

About (2R)-2-(5-bromothiophen-2-yl)piperidine

(2R)-2-(5-bromothiophen-2-yl)piperidine (PubChem CID 7048175) has the molecular formula C9H12BrNS and a molecular weight of 246.17 g/mol. Its IUPAC name is (2R)-2-(5-bromothiophen-2-yl)piperidine.

Molecular Properties

Compound Name(2R)-2-(5-bromothiophen-2-yl)piperidine
PubChem CID7048175
Molecular FormulaC9H12BrNS
Molecular Weight246.17 g/mol
Exact Mass244.99
IUPAC Name(2R)-2-(5-bromothiophen-2-yl)piperidine
SMILESBrc1ccc([C@H]2CCCCN2)s1
InChIInChI=1S/C9H12BrNS/c10-9-5-4-8(12-9)7-3-1-2-6-11-7/h4-5,7,11H,1-3,6H2/t7-/m1/s1
InChIKeyURXSDDBKOOFFJD-SSDOTTSWSA-N
XLogP3.33
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.17
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(5-methylthiophen-2-yl)piperidine
CID 7048171
2-(2,5-dibromothiophen-3-yl)azepane
CID 107959791
(2S)-2-(4,5-dibromothiophen-2-yl)piperidine
CID 130690046
2-(5-methoxythiophen-2-yl)piperidine
CID 130164086
5-pyrrolidin-2-ylthiophen-2-amine
CID 130002425
(2R)-2-(4,5-dibromothiophen-2-yl)pyrrolidine
CID 131001434
(2S)-2-thiophen-2-ylpiperidine
CID 7022116
N,N-dimethyl-5-[(2S)-pyrrolidin-2-yl]thiophen-2-amine
CID 55276512
(2S)-2-(4-bromophenyl)piperidine
CID 7022866
2-[(5-bromothiophen-2-yl)methyl]piperidine
CID 63086364
4-(5-bromothiophen-2-yl)-1-(pyrrolidin-2-ylmethyl)imidazolidin-2-one
CID 116979075
2-(2,4-dibromophenyl)azepane
CID 107938538

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(5-bromothiophen-2-yl)piperidine?
The IUPAC name of (2R)-2-(5-bromothiophen-2-yl)piperidine (CID 7048175) is (2R)-2-(5-bromothiophen-2-yl)piperidine.
What is the SMILES notation for (2R)-2-(5-bromothiophen-2-yl)piperidine?
The canonical SMILES for (2R)-2-(5-bromothiophen-2-yl)piperidine is Brc1ccc([C@H]2CCCCN2)s1.
What is the InChIKey of (2R)-2-(5-bromothiophen-2-yl)piperidine?
The InChIKey is URXSDDBKOOFFJD-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H12BrNS/c10-9-5-4-8(12-9)7-3-1-2-6-11-7/h4-5,7,11H,1-3,6H2/t7-/m1/s1.
What are the key properties of (2R)-2-(5-bromothiophen-2-yl)piperidine?
(2R)-2-(5-bromothiophen-2-yl)piperidine has a molecular weight of 246.17 g/mol, XLogP of 3.33, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(5-bromothiophen-2-yl)piperidine is sourced from PubChem (CID 7048175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).