(2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide

C16H20N4O5S2 — CID 2455935

IUPAC(2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide
SMILESC[C@@H](NCc1ccc(S(N)(=O)=O)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C16H20N4O5S2/c1-11(19-10-12-2-6-14(7-3-12)26(17,22)23)16(21)20-13-4-8-15(9-5-13)27(18,24)25/h2-9,11,19H,10H2,1H3,(H,20,21)(H2,17,22,23)(H2,18,24,25)/t11-/m1/s1
InChIKeySIAKKZIRIUJQEM-LLVKDONJSA-N
MW412.49 g/mol
LogP0.10
Rot. Bonds7

About (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide

(2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide (PubChem CID 2455935) has the molecular formula C16H20N4O5S2 and a molecular weight of 412.49 g/mol. Its IUPAC name is (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide.

Molecular Properties

Compound Name(2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide
PubChem CID2455935
Molecular FormulaC16H20N4O5S2
Molecular Weight412.49 g/mol
Exact Mass412.09
IUPAC Name(2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide
SMILESC[C@@H](NCc1ccc(S(N)(=O)=O)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C16H20N4O5S2/c1-11(19-10-12-2-6-14(7-3-12)26(17,22)23)16(21)20-13-4-8-15(9-5-13)27(18,24)25/h2-9,11,19H,10H2,1H3,(H,20,21)(H2,17,22,23)(H2,18,24,25)/t11-/m1/s1
InChIKeySIAKKZIRIUJQEM-LLVKDONJSA-N
XLogP0.10
TPSA161.45 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.49
LogP ≤ 50.10
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1,3-benzodioxol-5-ylmethylamino)-N-(4-sulfamoylphenyl)propanamide
CID 4845099
N-(2-benzoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide
CID 4868898
2-(benzylamino)-N-phenylpropanamide
CID 4877973
(2S)-2-(benzylamino)-N-phenylpropanamide
CID 2443956
2-methyl-3-(methylamino)-N-(4-sulfamoylphenyl)propanamide
CID 79195981
(2R)-2-[[(1S)-1-(4-ethylphenyl)-2-methylpropyl]amino]-N-(4-sulfamoylphenyl)propanamide
CID 8992451
(2S)-2-(1-adamantylmethylamino)-N-(4-sulfamoylphenyl)propanamide
CID 8512183
(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide
CID 670213
(2R)-N-(4-acetamidophenyl)-2-[(4-methoxyphenyl)methylamino]propanamide
CID 9322127
(2R)-2-[(4-fluorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)propanamide
CID 124549106
2-(3,5-dimethylanilino)-N-(4-sulfamoylphenyl)propanamide
CID 42912015
3-(3,4-dihydroxyphenyl)-2-methyl-N-(4-sulfamoylphenyl)propanamide
CID 84578792

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide?
The IUPAC name of (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide (CID 2455935) is (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide.
What is the SMILES notation for (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide?
The canonical SMILES for (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide is C[C@@H](NCc1ccc(S(N)(=O)=O)cc1)C(=O)Nc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide?
The InChIKey is SIAKKZIRIUJQEM-LLVKDONJSA-N. The full InChI is InChI=1S/C16H20N4O5S2/c1-11(19-10-12-2-6-14(7-3-12)26(17,22)23)16(21)20-13-4-8-15(9-5-13)27(18,24)25/h2-9,11,19H,10H2,1H3,(H,20,21)(H2,17,22,23)(H2,18,24,25)/t11-/m1/s1.
What are the key properties of (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide?
(2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide has a molecular weight of 412.49 g/mol, XLogP of 0.10, 7 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-sulfamoylphenyl)-2-[(4-sulfamoylphenyl)methylamino]propanamide is sourced from PubChem (CID 2455935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).