N-phenylpyrrolidine-1-sulfonamide

C10H14N2O2S — CID 45117555

IUPACN-phenylpyrrolidine-1-sulfonamide
SMILESO=S(=O)(Nc1ccccc1)N1CCCC1
InChIInChI=1S/C10H14N2O2S/c13-15(14,12-8-4-5-9-12)11-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
InChIKeyUBFFWQNKFRRZHQ-UHFFFAOYSA-N
MW226.30 g/mol
LogP1.44
Rot. Bonds3

About N-phenylpyrrolidine-1-sulfonamide

N-phenylpyrrolidine-1-sulfonamide (PubChem CID 45117555) has the molecular formula C10H14N2O2S and a molecular weight of 226.30 g/mol. Its IUPAC name is N-phenylpyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-phenylpyrrolidine-1-sulfonamide
PubChem CID45117555
Molecular FormulaC10H14N2O2S
Molecular Weight226.30 g/mol
Exact Mass226.08
IUPAC NameN-phenylpyrrolidine-1-sulfonamide
SMILESO=S(=O)(Nc1ccccc1)N1CCCC1
InChIInChI=1S/C10H14N2O2S/c13-15(14,12-8-4-5-9-12)11-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2
InChIKeyUBFFWQNKFRRZHQ-UHFFFAOYSA-N
XLogP1.44
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminophenyl)piperidine-1-sulfonamide
CID 28783328
N-(3-formylphenyl)pyrrolidine-1-sulfonamide
CID 106912985
N-(3-formylphenyl)piperidine-1-sulfonamide
CID 106913023
N-phenyl-3,4-dihydro-1H-isoquinoline-2-sulfonamide
CID 10891526
N-(4-cyanophenyl)piperidine-1-sulfonamide
CID 28785044
N-phenyl-4-propanoylpiperazine-1-sulfonamide
CID 168727149
3-[4-(pyrrolidin-1-ylsulfonylamino)phenyl]propanoic acid
CID 115339542
N-[4-(2-hydroxyethyl)phenyl]azepane-1-sulfonamide
CID 61223235
ethyl 1-(phenylsulfamoyl)piperidine-3-carboxylate
CID 64591199
N-[3-(methylaminomethyl)phenyl]piperidine-1-sulfonamide
CID 43606208
N-[4-(2,6-dioxopiperidin-4-yl)phenyl]azepane-1-sulfonamide
CID 154736424
N-(4-propan-2-yloxyphenyl)piperidine-1-sulfonamide
CID 110705941

Frequently Asked Questions

What is the IUPAC name of N-phenylpyrrolidine-1-sulfonamide?
The IUPAC name of N-phenylpyrrolidine-1-sulfonamide (CID 45117555) is N-phenylpyrrolidine-1-sulfonamide.
What is the SMILES notation for N-phenylpyrrolidine-1-sulfonamide?
The canonical SMILES for N-phenylpyrrolidine-1-sulfonamide is O=S(=O)(Nc1ccccc1)N1CCCC1.
What is the InChIKey of N-phenylpyrrolidine-1-sulfonamide?
The InChIKey is UBFFWQNKFRRZHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2S/c13-15(14,12-8-4-5-9-12)11-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2.
What are the key properties of N-phenylpyrrolidine-1-sulfonamide?
N-phenylpyrrolidine-1-sulfonamide has a molecular weight of 226.30 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylpyrrolidine-1-sulfonamide is sourced from PubChem (CID 45117555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).