N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide

C16H25N3O3S — CID 8901829

IUPACN-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2CCCC2)cc1
InChIInChI=1S/C16H25N3O3S/c1-3-19(4-2)23(21,22)15-9-7-14(8-10-15)17-16(20)13-18-11-5-6-12-18/h7-10H,3-6,11-13H2,1-2H3,(H,17,20)
InChIKeyKQLIOBOFYZTCPL-UHFFFAOYSA-N
MW339.46 g/mol
LogP1.75
Rot. Bonds7

About N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide

N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide (PubChem CID 8901829) has the molecular formula C16H25N3O3S and a molecular weight of 339.46 g/mol. Its IUPAC name is N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide.

Molecular Properties

Compound NameN-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide
PubChem CID8901829
Molecular FormulaC16H25N3O3S
Molecular Weight339.46 g/mol
Exact Mass339.16
IUPAC NameN-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2CCCC2)cc1
InChIInChI=1S/C16H25N3O3S/c1-3-19(4-2)23(21,22)15-9-7-14(8-10-15)17-16(20)13-18-11-5-6-12-18/h7-10H,3-6,11-13H2,1-2H3,(H,17,20)
InChIKeyKQLIOBOFYZTCPL-UHFFFAOYSA-N
XLogP1.75
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.46
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(diethylsulfamoyl)phenyl]-2-[(3R)-3-methylpiperidin-1-yl]acetamide
CID 2681860
2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 11931064
2-(azepan-1-yl)-N-(4-sulfamoylphenyl)acetamide
CID 732235
2-bromo-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 46736589
N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ium-1-ylacetamide
CID 8901828
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-pyrrolidin-1-ylacetamide;hydrochloride
CID 171668777
N-[4-(diethylsulfamoyl)phenyl]-4-(piperidin-1-ylmethyl)benzamide
CID 41468608
N-[4-[[2-(azepan-1-yl)acetyl]amino]phenyl]propanamide
CID 54814408
N-[4-[[(2R)-butan-2-yl]sulfamoyl]phenyl]-2-piperidin-1-ylacetamide
CID 51686284
N-[4-(diethylsulfamoyl)phenyl]-2-(2,3-dihydroindol-1-yl)acetamide
CID 2654347
N-[4-(diethylsulfamoyl)phenyl]-2-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]acetamide
CID 43048633
N-[4-(dimethylsulfamoyl)phenyl]-2-(4-methylpiperazin-1-yl)acetamide
CID 1439115

Frequently Asked Questions

What is the IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide?
The IUPAC name of N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide (CID 8901829) is N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide.
What is the SMILES notation for N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide?
The canonical SMILES for N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)CN2CCCC2)cc1.
What is the InChIKey of N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide?
The InChIKey is KQLIOBOFYZTCPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3S/c1-3-19(4-2)23(21,22)15-9-7-14(8-10-15)17-16(20)13-18-11-5-6-12-18/h7-10H,3-6,11-13H2,1-2H3,(H,17,20).
What are the key properties of N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide?
N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide has a molecular weight of 339.46 g/mol, XLogP of 1.75, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(diethylsulfamoyl)phenyl]-2-pyrrolidin-1-ylacetamide is sourced from PubChem (CID 8901829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).