(2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide

C15H24N4O5S2 — CID 41331851

IUPAC(2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide
SMILESC[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)N1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C15H24N4O5S2/c1-11(19-9-7-13(8-10-19)18-25(2,21)22)15(20)17-12-3-5-14(6-4-12)26(16,23)24/h3-6,11,13,18H,7-10H2,1-2H3,(H,17,20)(H2,16,23,24)/t11-/m0/s1
InChIKeyCUTUMZAYTFZXOY-NSHDSACASA-N
MW404.51 g/mol
LogP-0.33
Rot. Bonds6

About (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide

(2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide (PubChem CID 41331851) has the molecular formula C15H24N4O5S2 and a molecular weight of 404.51 g/mol. Its IUPAC name is (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide.

Molecular Properties

Compound Name(2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide
PubChem CID41331851
Molecular FormulaC15H24N4O5S2
Molecular Weight404.51 g/mol
Exact Mass404.12
IUPAC Name(2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide
SMILESC[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)N1CCC(NS(C)(=O)=O)CC1
InChIInChI=1S/C15H24N4O5S2/c1-11(19-9-7-13(8-10-19)18-25(2,21)22)15(20)17-12-3-5-14(6-4-12)26(16,23)24/h3-6,11,13,18H,7-10H2,1-2H3,(H,17,20)(H2,16,23,24)/t11-/m0/s1
InChIKeyCUTUMZAYTFZXOY-NSHDSACASA-N
XLogP-0.33
TPSA138.67 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.51
LogP ≤ 5-0.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)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

(2R)-N-(2,3-dihydro-1H-inden-5-yl)-2-[4-(methanesulfonamido)piperidin-1-yl]propanamide
CID 42122346
2-[3-(methylamino)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide;hydrochloride
CID 119918352
2-(4-benzhydrylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide
CID 42996416
2-(4-phenylpiperazin-1-yl)-N-(4-sulfamoylphenyl)propanamide
CID 42911835
N-(2,4-difluorophenyl)-2-[4-(methanesulfonamido)piperidin-1-yl]propanamide
CID 86914703
(3S)-1-[(2S)-1-oxo-1-(4-sulfamoylanilino)propan-2-yl]-N-phenylpiperidine-3-carboxamide
CID 51672985
N-(4-sulfamoylphenyl)-2-[4-(1,3-thiazol-2-yl)piperazin-1-yl]propanamide
CID 55499702
N-ethyl-1-[1-oxo-1-(4-sulfamoylanilino)propan-2-yl]piperidine-3-carboxamide
CID 48938077
(2S)-N-(2-chloro-5-nitrophenyl)-2-[4-(methanesulfonamido)piperidin-1-yl]propanamide
CID 41331845
2-[4-(2-nitrophenyl)piperazin-1-yl]-N-(4-sulfamoylphenyl)propanamide
CID 42998927
1-[1-(4-aminoanilino)-1-oxopropan-2-yl]piperidine-4-carboxamide
CID 16781124
N-(4-methylsulfonylphenyl)-2-piperazin-1-ylpropanamide
CID 43130677

Frequently Asked Questions

What is the IUPAC name of (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide?
The IUPAC name of (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide (CID 41331851) is (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide.
What is the SMILES notation for (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide?
The canonical SMILES for (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide is C[C@@H](C(=O)Nc1ccc(S(N)(=O)=O)cc1)N1CCC(NS(C)(=O)=O)CC1.
What is the InChIKey of (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide?
The InChIKey is CUTUMZAYTFZXOY-NSHDSACASA-N. The full InChI is InChI=1S/C15H24N4O5S2/c1-11(19-9-7-13(8-10-19)18-25(2,21)22)15(20)17-12-3-5-14(6-4-12)26(16,23)24/h3-6,11,13,18H,7-10H2,1-2H3,(H,17,20)(H2,16,23,24)/t11-/m0/s1.
What are the key properties of (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide?
(2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide has a molecular weight of 404.51 g/mol, XLogP of -0.33, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-[4-(methanesulfonamido)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide is sourced from PubChem (CID 41331851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).