(2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide

C18H22N4O3S — CID 41484317

IUPAC(2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide
SMILESCN1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H](c2ccccc2)C1
InChIInChI=1S/C18H22N4O3S/c1-21-11-12-22(17(13-21)14-5-3-2-4-6-14)18(23)20-15-7-9-16(10-8-15)26(19,24)25/h2-10,17H,11-13H2,1H3,(H,20,23)(H2,19,24,25)/t17-/m0/s1
InChIKeyJRHZZSILXVSDSG-KRWDZBQOSA-N
MW374.47 g/mol
LogP1.85
Rot. Bonds3

About (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide

(2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide (PubChem CID 41484317) has the molecular formula C18H22N4O3S and a molecular weight of 374.47 g/mol. Its IUPAC name is (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name(2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide
PubChem CID41484317
Molecular FormulaC18H22N4O3S
Molecular Weight374.47 g/mol
Exact Mass374.14
IUPAC Name(2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide
SMILESCN1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H](c2ccccc2)C1
InChIInChI=1S/C18H22N4O3S/c1-21-11-12-22(17(13-21)14-5-3-2-4-6-14)18(23)20-15-7-9-16(10-8-15)26(19,24)25/h2-10,17H,11-13H2,1H3,(H,20,23)(H2,19,24,25)/t17-/m0/s1
InChIKeyJRHZZSILXVSDSG-KRWDZBQOSA-N
XLogP1.85
TPSA95.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.47
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide
CID 42934686
4-methyl-N-(4-methylphenyl)-2-phenylpiperazine-1-carboxamide
CID 24612409
(2R)-4-methyl-N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylpiperazine-1-carboxamide
CID 97314638
(2S)-4-methyl-2-phenyl-N-[4-(2,2,2-trifluoroethylcarbamoyl)phenyl]piperazine-1-carboxamide
CID 51945996
4-[(2S)-4-methyl-2-phenylpiperazine-1-carbonyl]-N-phenylpiperidine-1-carboxamide
CID 37332906
4-[(2R)-4-methyl-2-phenylpiperazine-1-carbonyl]-N-phenylpiperidine-1-carboxamide
CID 37332907
4-methyl-N-[(4-methylsulfonylphenyl)methyl]-2-phenylpiperazine-1-carboxamide
CID 136577422
N-[4-(dimethylsulfamoyl)phenyl]-2-phenylazetidine-1-carboxamide
CID 51116324
(2S)-N-[3-(difluoromethoxy)phenyl]-4-methyl-2-phenylpiperazine-1-carboxamide
CID 51952919
2-[(4-methyl-2-phenylpiperazine-1-carbonyl)amino]propanoic acid
CID 61181654
4-methyl-N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-2-phenylpiperazine-1-carboxamide
CID 47041629
N-(2-chloropropanoyl)-4-methyl-2-phenylpiperazine-1-carboxamide
CID 43328757

Frequently Asked Questions

What is the IUPAC name of (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide?
The IUPAC name of (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide (CID 41484317) is (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide.
What is the SMILES notation for (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide?
The canonical SMILES for (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide is CN1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H](c2ccccc2)C1.
What is the InChIKey of (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide?
The InChIKey is JRHZZSILXVSDSG-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H22N4O3S/c1-21-11-12-22(17(13-21)14-5-3-2-4-6-14)18(23)20-15-7-9-16(10-8-15)26(19,24)25/h2-10,17H,11-13H2,1H3,(H,20,23)(H2,19,24,25)/t17-/m0/s1.
What are the key properties of (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide?
(2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide has a molecular weight of 374.47 g/mol, XLogP of 1.85, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methyl-2-phenyl-N-(4-sulfamoylphenyl)piperazine-1-carboxamide is sourced from PubChem (CID 41484317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).