N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide

C11H16N2O4S — CID 103760192

IUPACN-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide
SMILESCOc1ccc(O)c(NS(=O)(=O)N2CCCC2)c1
InChIInChI=1S/C11H16N2O4S/c1-17-9-4-5-11(14)10(8-9)12-18(15,16)13-6-2-3-7-13/h4-5,8,12,14H,2-3,6-7H2,1H3
InChIKeyYEZCPRMFFYZZQY-UHFFFAOYSA-N
MW272.33 g/mol
LogP1.15
Rot. Bonds4

About N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide

N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide (PubChem CID 103760192) has the molecular formula C11H16N2O4S and a molecular weight of 272.33 g/mol. Its IUPAC name is N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide
PubChem CID103760192
Molecular FormulaC11H16N2O4S
Molecular Weight272.33 g/mol
Exact Mass272.08
IUPAC NameN-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide
SMILESCOc1ccc(O)c(NS(=O)(=O)N2CCCC2)c1
InChIInChI=1S/C11H16N2O4S/c1-17-9-4-5-11(14)10(8-9)12-18(15,16)13-6-2-3-7-13/h4-5,8,12,14H,2-3,6-7H2,1H3
InChIKeyYEZCPRMFFYZZQY-UHFFFAOYSA-N
XLogP1.15
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.33
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-hydroxy-5-methoxyphenyl)-4-methylpiperidine-1-sulfonamide
CID 102696009
N-(2-amino-5-methoxyphenyl)piperidine-1-sulfonamide
CID 63258793
N-(2-bromo-5-methoxyphenyl)azepane-1-sulfonamide
CID 63997402
N-(2-hydroxy-5-methylphenyl)pyrrolidine-1-sulfonamide
CID 54936857
N-(2,5-dihydroxyphenyl)pyrrolidine-1-sulfonamide
CID 154467539
N-(2-iodo-5-methoxyphenyl)azetidine-1-sulfonamide
CID 167940813
N-(2-amino-4-methoxyphenyl)azepane-1-sulfonamide
CID 28783253
N-(2-hydroxy-5-methoxyphenyl)-2-methylpropane-1-sulfonamide
CID 113256472
N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3,5-dimethoxybenzamide
CID 27672633
N-(4-amino-2-methoxyphenyl)piperidine-1-sulfonamide
CID 28783407
propan-2-yl N-[(2-hydroxy-5-methoxyphenyl)sulfamoyl]carbamate
CID 102696028
N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-3-(3-methoxyphenyl)propanamide
CID 24543222

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide (CID 103760192) is N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide is COc1ccc(O)c(NS(=O)(=O)N2CCCC2)c1.
What is the InChIKey of N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide?
The InChIKey is YEZCPRMFFYZZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S/c1-17-9-4-5-11(14)10(8-9)12-18(15,16)13-6-2-3-7-13/h4-5,8,12,14H,2-3,6-7H2,1H3.
What are the key properties of N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide?
N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide has a molecular weight of 272.33 g/mol, XLogP of 1.15, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-5-methoxyphenyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 103760192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).