N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide

C17H18ClN3O3S — CID 7376470

IUPACN-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)N1CCCC1
InChIInChI=1S/C17H18ClN3O3S/c18-15-5-1-2-6-16(15)20-25(23,24)14-9-7-13(8-10-14)19-17(22)21-11-3-4-12-21/h1-2,5-10,20H,3-4,11-12H2,(H,19,22)
InChIKeyQXARYDKMOSBDFZ-UHFFFAOYSA-N
MW379.87 g/mol
LogP3.77
Rot. Bonds4

About N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide

N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide (PubChem CID 7376470) has the molecular formula C17H18ClN3O3S and a molecular weight of 379.87 g/mol. Its IUPAC name is N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide
PubChem CID7376470
Molecular FormulaC17H18ClN3O3S
Molecular Weight379.87 g/mol
Exact Mass379.08
IUPAC NameN-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)N1CCCC1
InChIInChI=1S/C17H18ClN3O3S/c18-15-5-1-2-6-16(15)20-25(23,24)14-9-7-13(8-10-14)19-17(22)21-11-3-4-12-21/h1-2,5-10,20H,3-4,11-12H2,(H,19,22)
InChIKeyQXARYDKMOSBDFZ-UHFFFAOYSA-N
XLogP3.77
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.87
LogP ≤ 53.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(2,3-dimethylphenyl)sulfamoyl]phenyl]piperidine-1-carboxamide
CID 6459006
N-[4-[(3-chlorophenyl)sulfamoyl]phenyl]piperidine-1-carboxamide
CID 7376472
N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide
CID 6460433
N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide
CID 7369582
1-benzyl-3-[4-[(2-chlorophenyl)sulfamoyl]phenyl]urea
CID 135223291
N-(4-sulfamoylphenyl)azocane-1-carboxamide
CID 17414007
N-(2-chlorophenyl)-4-(methanesulfonamido)benzenesulfonamide
CID 2467720
N-[2-[(4-butan-2-ylphenyl)sulfonylamino]phenyl]pyrrolidine-1-carboxamide
CID 60534416
N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]-4-methylbenzenesulfonamide
CID 1318754
N-[4-[(3-acetylphenyl)sulfamoyl]phenyl]piperidine-1-carboxamide
CID 2985508
4-(3-aminopiperidine-1-carbonyl)-N-(2-chlorophenyl)benzenesulfonamide
CID 119378363
N-[4-(prop-2-enylsulfamoyl)phenyl]piperidine-1-carboxamide
CID 2990833

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide (CID 7376470) is N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide is O=C(Nc1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1)N1CCCC1.
What is the InChIKey of N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide?
The InChIKey is QXARYDKMOSBDFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClN3O3S/c18-15-5-1-2-6-16(15)20-25(23,24)14-9-7-13(8-10-14)19-17(22)21-11-3-4-12-21/h1-2,5-10,20H,3-4,11-12H2,(H,19,22).
What are the key properties of N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide?
N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide has a molecular weight of 379.87 g/mol, XLogP of 3.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 7376470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).