2-[2-(2-bromocyclopentyl)ethyl]thiophene

C11H15BrS — CID 63774443

IUPAC2-[2-(2-bromocyclopentyl)ethyl]thiophene
SMILESBrC1CCCC1CCc1cccs1
InChIInChI=1S/C11H15BrS/c12-11-5-1-3-9(11)6-7-10-4-2-8-13-10/h2,4,8-9,11H,1,3,5-7H2
InChIKeyJAMRCKLJSGLMAR-UHFFFAOYSA-N
MW259.21 g/mol
LogP4.24
Rot. Bonds3

About 2-[2-(2-bromocyclopentyl)ethyl]thiophene

2-[2-(2-bromocyclopentyl)ethyl]thiophene (PubChem CID 63774443) has the molecular formula C11H15BrS and a molecular weight of 259.21 g/mol. Its IUPAC name is 2-[2-(2-bromocyclopentyl)ethyl]thiophene.

Molecular Properties

Compound Name2-[2-(2-bromocyclopentyl)ethyl]thiophene
PubChem CID63774443
Molecular FormulaC11H15BrS
Molecular Weight259.21 g/mol
Exact Mass258.01
IUPAC Name2-[2-(2-bromocyclopentyl)ethyl]thiophene
SMILESBrC1CCCC1CCc1cccs1
InChIInChI=1S/C11H15BrS/c12-11-5-1-3-9(11)6-7-10-4-2-8-13-10/h2,4,8-9,11H,1,3,5-7H2
InChIKeyJAMRCKLJSGLMAR-UHFFFAOYSA-N
XLogP4.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.21
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-methyl-2-(2-thiophen-2-ylethyl)cyclopentan-1-amine
CID 63776082
N-propyl-2-(2-thiophen-2-ylethyl)cyclohexan-1-amine
CID 55237095
2-[2-(3-chlorocyclohexyl)ethyl]thiophene
CID 64515904
2-[2-(3-chloro-2-methylcyclopentyl)ethyl]thiophene
CID 64909685
2-[[(1R,2S)-2-hydroxycyclopentyl]methyl]-1-(2-thiophen-2-ylethyl)guanidine
CID 122098466
N-[[2-(2-thiophen-2-ylethyl)cyclobutyl]methyl]propan-1-amine
CID 81017720
1-cyclobutyl-N-(2-thiophen-2-ylethyl)ethanamine
CID 115706476
2-[2-(3-chlorocycloheptyl)ethyl]thiophene
CID 64507957
2-(2-thiophen-2-ylethyl)cyclohexan-1-one
CID 63773659
2-(4-cyclohexylbutyl)thiophene
CID 142713613
3-cyclopentyl-N-(2-thiophen-2-ylethyl)propan-1-amine
CID 106010634
1-cyclobutyl-3-thiophen-2-ylpropan-1-one
CID 64982146

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-bromocyclopentyl)ethyl]thiophene?
The IUPAC name of 2-[2-(2-bromocyclopentyl)ethyl]thiophene (CID 63774443) is 2-[2-(2-bromocyclopentyl)ethyl]thiophene.
What is the SMILES notation for 2-[2-(2-bromocyclopentyl)ethyl]thiophene?
The canonical SMILES for 2-[2-(2-bromocyclopentyl)ethyl]thiophene is BrC1CCCC1CCc1cccs1.
What is the InChIKey of 2-[2-(2-bromocyclopentyl)ethyl]thiophene?
The InChIKey is JAMRCKLJSGLMAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15BrS/c12-11-5-1-3-9(11)6-7-10-4-2-8-13-10/h2,4,8-9,11H,1,3,5-7H2.
What are the key properties of 2-[2-(2-bromocyclopentyl)ethyl]thiophene?
2-[2-(2-bromocyclopentyl)ethyl]thiophene has a molecular weight of 259.21 g/mol, XLogP of 4.24, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-bromocyclopentyl)ethyl]thiophene is sourced from PubChem (CID 63774443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).