(2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide

C19H23N3O3S — CID 154569424

IUPAC(2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)[C@H]2CC[C@H](c3ccccc3)N2)cc1
InChIInChI=1S/C19H23N3O3S/c20-26(24,25)16-8-6-14(7-9-16)12-13-21-19(23)18-11-10-17(22-18)15-4-2-1-3-5-15/h1-9,17-18,22H,10-13H2,(H,21,23)(H2,20,24,25)/t17-,18-/m1/s1
InChIKeyZPCDDYJXFZWJGT-QZTJIDSGSA-N
MW373.48 g/mol
LogP1.49
Rot. Bonds6

About (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide

(2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide (PubChem CID 154569424) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name(2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide
PubChem CID154569424
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC Name(2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)[C@H]2CC[C@H](c3ccccc3)N2)cc1
InChIInChI=1S/C19H23N3O3S/c20-26(24,25)16-8-6-14(7-9-16)12-13-21-19(23)18-11-10-17(22-18)15-4-2-1-3-5-15/h1-9,17-18,22H,10-13H2,(H,21,23)(H2,20,24,25)/t17-,18-/m1/s1
InChIKeyZPCDDYJXFZWJGT-QZTJIDSGSA-N
XLogP1.49
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 51.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-sulfamoylphenyl)ethyl]cyclopent-3-ene-1-carboxamide
CID 64766938
trans-(1S,3S)-2,2-dimethyl-3-[2-(4-sulfamoylphenyl)ethylcarbamoyl]cyclopropane-1-carboxylic acid
CID 95390266
(2R)-N-[2-(4-sulfamoylphenyl)ethyl]-2,5-dihydro-1H-pyrrole-2-carboxamide
CID 125435841
(2S)-N-[(4-sulfamoylphenyl)methyl]pyrrolidine-2-carboxamide
CID 22691434
cis-(1S,2R)-2-phenyl-N-[(4-sulfamoylphenyl)methyl]cyclopropane-1-carboxamide
CID 40606359
1-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]cyclopropane-1-carboxamide
CID 2650232
N-[2-(4-sulfamoylphenyl)ethyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 18089481
(2S)-N-[2-(4-sulfamoylphenyl)ethyl]-2,3-dihydro-1-benzothiophene-2-carboxamide
CID 26015643
(2R,5R)-N-[2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)ethyl]-5-phenylpyrrolidine-2-carboxamide
CID 155508548
(3R)-5-oxo-1-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-3-carboxamide
CID 9350652
1-(4-phenylbutyl)-3-[2-(4-sulfamoylphenyl)ethyl]urea
CID 118398414
N-[(4-sulfamoylphenyl)methyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119263305

Frequently Asked Questions

What is the IUPAC name of (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide?
The IUPAC name of (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide (CID 154569424) is (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide?
The canonical SMILES for (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide is NS(=O)(=O)c1ccc(CCNC(=O)[C@H]2CC[C@H](c3ccccc3)N2)cc1.
What is the InChIKey of (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide?
The InChIKey is ZPCDDYJXFZWJGT-QZTJIDSGSA-N. The full InChI is InChI=1S/C19H23N3O3S/c20-26(24,25)16-8-6-14(7-9-16)12-13-21-19(23)18-11-10-17(22-18)15-4-2-1-3-5-15/h1-9,17-18,22H,10-13H2,(H,21,23)(H2,20,24,25)/t17-,18-/m1/s1.
What are the key properties of (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide?
(2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide has a molecular weight of 373.48 g/mol, XLogP of 1.49, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-5-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 154569424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).