N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide

C19H23N3O3S — CID 7369582

IUPACN-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide
SMILESC[C@@H](NS(=O)(=O)c1ccc(NC(=O)N2CCCC2)cc1)c1ccccc1
InChIInChI=1S/C19H23N3O3S/c1-15(16-7-3-2-4-8-16)21-26(24,25)18-11-9-17(10-12-18)20-19(23)22-13-5-6-14-22/h2-4,7-12,15,21H,5-6,13-14H2,1H3,(H,20,23)/t15-/m1/s1
InChIKeyMPFITVZXVSPXET-OAHLLOKOSA-N
MW373.48 g/mol
LogP3.35
Rot. Bonds5

About N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide

N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide (PubChem CID 7369582) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide
PubChem CID7369582
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC NameN-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide
SMILESC[C@@H](NS(=O)(=O)c1ccc(NC(=O)N2CCCC2)cc1)c1ccccc1
InChIInChI=1S/C19H23N3O3S/c1-15(16-7-3-2-4-8-16)21-26(24,25)18-11-9-17(10-12-18)20-19(23)22-13-5-6-14-22/h2-4,7-12,15,21H,5-6,13-14H2,1H3,(H,20,23)/t15-/m1/s1
InChIKeyMPFITVZXVSPXET-OAHLLOKOSA-N
XLogP3.35
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[[(1S)-1-phenylethyl]sulfamoyl]phenyl]acetamide
CID 730422
N-(1-phenylethyl)-4-(piperidine-1-carbonyl)benzenesulfonamide
CID 109059411
N-[4-[1-(methylamino)ethyl]phenyl]pyrrolidine-1-carboxamide
CID 61339985
4-(2-oxo-2-piperidin-1-ylethoxy)-N-(1-phenylethyl)benzenesulfonamide
CID 2947715
4-[2-(azepan-1-yl)-2-oxoethoxy]-N-(1-phenylethyl)benzenesulfonamide
CID 4213059
4-(3-methylpiperidine-1-carbonyl)-N-(1-phenylethyl)benzenesulfonamide
CID 109060714
N-[4-[(2-chlorophenyl)sulfamoyl]phenyl]pyrrolidine-1-carboxamide
CID 7376470
N-(1-phenylethyl)pyrrolidine-1-carboxamide
CID 108987850
N-(1-phenylethyl)-4-(1,2,2-tricyanoethenylamino)benzenesulfonamide
CID 168608712
2,2-diphenyl-N-[4-(propan-2-ylsulfamoyl)phenyl]acetamide
CID 1263402
3-[[(1S)-1-phenylethyl]sulfamoyl]-N-(4-piperidin-1-ylphenyl)benzamide
CID 25362186
N-(1-phenylethyl)benzenesulfonamide;hydrochloride
CID 70281153

Frequently Asked Questions

What is the IUPAC name of N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide (CID 7369582) is N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide is C[C@@H](NS(=O)(=O)c1ccc(NC(=O)N2CCCC2)cc1)c1ccccc1.
What is the InChIKey of N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide?
The InChIKey is MPFITVZXVSPXET-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-15(16-7-3-2-4-8-16)21-26(24,25)18-11-9-17(10-12-18)20-19(23)22-13-5-6-14-22/h2-4,7-12,15,21H,5-6,13-14H2,1H3,(H,20,23)/t15-/m1/s1.
What are the key properties of N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide?
N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide has a molecular weight of 373.48 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[(1R)-1-phenylethyl]sulfamoyl]phenyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 7369582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).