2-amino-4-cyclopentyloxybenzenesulfonamide

C11H16N2O3S — CID 79466823

IUPAC2-amino-4-cyclopentyloxybenzenesulfonamide
SMILESNc1cc(OC2CCCC2)ccc1S(N)(=O)=O
InChIInChI=1S/C11H16N2O3S/c12-10-7-9(16-8-3-1-2-4-8)5-6-11(10)17(13,14)15/h5-8H,1-4,12H2,(H2,13,14,15)
InChIKeyIUDVDFKLCWLPIK-UHFFFAOYSA-N
MW256.33 g/mol
LogP1.24
Rot. Bonds3

About 2-amino-4-cyclopentyloxybenzenesulfonamide

2-amino-4-cyclopentyloxybenzenesulfonamide (PubChem CID 79466823) has the molecular formula C11H16N2O3S and a molecular weight of 256.33 g/mol. Its IUPAC name is 2-amino-4-cyclopentyloxybenzenesulfonamide.

Molecular Properties

Compound Name2-amino-4-cyclopentyloxybenzenesulfonamide
PubChem CID79466823
Molecular FormulaC11H16N2O3S
Molecular Weight256.33 g/mol
Exact Mass256.09
IUPAC Name2-amino-4-cyclopentyloxybenzenesulfonamide
SMILESNc1cc(OC2CCCC2)ccc1S(N)(=O)=O
InChIInChI=1S/C11H16N2O3S/c12-10-7-9(16-8-3-1-2-4-8)5-6-11(10)17(13,14)15/h5-8H,1-4,12H2,(H2,13,14,15)
InChIKeyIUDVDFKLCWLPIK-UHFFFAOYSA-N
XLogP1.24
TPSA95.41 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.33
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-cyclopentyloxybenzenesulfonamide
CID 43164525
2-cyclohexyloxy-4-methoxybenzenesulfonamide
CID 69224689
2-(aminomethyl)-4-cyclopentyloxyaniline
CID 82507186
4-(4,4-dimethylcyclohexyl)oxybenzene-1,2-diamine
CID 106748575
4-cyclohexyloxy-2,3-dimethylbenzenesulfonamide
CID 43342353
(3-cyclohexyloxy-4-sulfamoylphenyl)boronic acid
CID 67097987
1-(2-amino-5-cyclohexyloxyphenyl)ethanone
CID 113433081
2-amino-4-(2-methylbutan-2-yloxy)benzenesulfonamide
CID 79467435
2-amino-4-(3-methoxyphenoxy)benzenesulfonamide
CID 79467005
2-amino-4-phenylmethoxybenzenesulfonamide
CID 79466915
2-amino-4-(3-chlorophenoxy)benzenesulfonamide
CID 79467084
2-amino-4-[(2-methoxycyclopentyl)amino]benzenesulfonamide
CID 79467242

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-cyclopentyloxybenzenesulfonamide?
The IUPAC name of 2-amino-4-cyclopentyloxybenzenesulfonamide (CID 79466823) is 2-amino-4-cyclopentyloxybenzenesulfonamide.
What is the SMILES notation for 2-amino-4-cyclopentyloxybenzenesulfonamide?
The canonical SMILES for 2-amino-4-cyclopentyloxybenzenesulfonamide is Nc1cc(OC2CCCC2)ccc1S(N)(=O)=O.
What is the InChIKey of 2-amino-4-cyclopentyloxybenzenesulfonamide?
The InChIKey is IUDVDFKLCWLPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3S/c12-10-7-9(16-8-3-1-2-4-8)5-6-11(10)17(13,14)15/h5-8H,1-4,12H2,(H2,13,14,15).
What are the key properties of 2-amino-4-cyclopentyloxybenzenesulfonamide?
2-amino-4-cyclopentyloxybenzenesulfonamide has a molecular weight of 256.33 g/mol, XLogP of 1.24, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-cyclopentyloxybenzenesulfonamide is sourced from PubChem (CID 79466823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).