N-(2-bromocyclopentyl)cyclopropanesulfonamide

C8H14BrNO2S — CID 80661546

IUPACN-(2-bromocyclopentyl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCCC1Br)C1CC1
InChIInChI=1S/C8H14BrNO2S/c9-7-2-1-3-8(7)10-13(11,12)6-4-5-6/h6-8,10H,1-5H2
InChIKeyVYYFPUPDCJFPRU-UHFFFAOYSA-N
MW268.18 g/mol
LogP1.38
Rot. Bonds3

About N-(2-bromocyclopentyl)cyclopropanesulfonamide

N-(2-bromocyclopentyl)cyclopropanesulfonamide (PubChem CID 80661546) has the molecular formula C8H14BrNO2S and a molecular weight of 268.18 g/mol. Its IUPAC name is N-(2-bromocyclopentyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(2-bromocyclopentyl)cyclopropanesulfonamide
PubChem CID80661546
Molecular FormulaC8H14BrNO2S
Molecular Weight268.18 g/mol
Exact Mass266.99
IUPAC NameN-(2-bromocyclopentyl)cyclopropanesulfonamide
SMILESO=S(=O)(NC1CCCC1Br)C1CC1
InChIInChI=1S/C8H14BrNO2S/c9-7-2-1-3-8(7)10-13(11,12)6-4-5-6/h6-8,10H,1-5H2
InChIKeyVYYFPUPDCJFPRU-UHFFFAOYSA-N
XLogP1.38
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.18
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-bromocyclopentyl)cyclopropanesulfonamide?
The IUPAC name of N-(2-bromocyclopentyl)cyclopropanesulfonamide (CID 80661546) is N-(2-bromocyclopentyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(2-bromocyclopentyl)cyclopropanesulfonamide?
The canonical SMILES for N-(2-bromocyclopentyl)cyclopropanesulfonamide is O=S(=O)(NC1CCCC1Br)C1CC1.
What is the InChIKey of N-(2-bromocyclopentyl)cyclopropanesulfonamide?
The InChIKey is VYYFPUPDCJFPRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14BrNO2S/c9-7-2-1-3-8(7)10-13(11,12)6-4-5-6/h6-8,10H,1-5H2.
What are the key properties of N-(2-bromocyclopentyl)cyclopropanesulfonamide?
N-(2-bromocyclopentyl)cyclopropanesulfonamide has a molecular weight of 268.18 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromocyclopentyl)cyclopropanesulfonamide is sourced from PubChem (CID 80661546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).