2-(benzenesulfonamido)pentanediamide

C11H15N3O4S — CID 71384470

IUPAC2-(benzenesulfonamido)pentanediamide
SMILESNC(=O)CCC(NS(=O)(=O)c1ccccc1)C(N)=O
InChIInChI=1S/C11H15N3O4S/c12-10(15)7-6-9(11(13)16)14-19(17,18)8-4-2-1-3-5-8/h1-5,9,14H,6-7H2,(H2,12,15)(H2,13,16)
InChIKeyHVUNEICOGCOCHG-UHFFFAOYSA-N
MW285.32 g/mol
LogP-0.92
Rot. Bonds7

About 2-(benzenesulfonamido)pentanediamide

2-(benzenesulfonamido)pentanediamide (PubChem CID 71384470) has the molecular formula C11H15N3O4S and a molecular weight of 285.32 g/mol. Its IUPAC name is 2-(benzenesulfonamido)pentanediamide.

Molecular Properties

Compound Name2-(benzenesulfonamido)pentanediamide
PubChem CID71384470
Molecular FormulaC11H15N3O4S
Molecular Weight285.32 g/mol
Exact Mass285.08
IUPAC Name2-(benzenesulfonamido)pentanediamide
SMILESNC(=O)CCC(NS(=O)(=O)c1ccccc1)C(N)=O
InChIInChI=1S/C11H15N3O4S/c12-10(15)7-6-9(11(13)16)14-19(17,18)8-4-2-1-3-5-8/h1-5,9,14H,6-7H2,(H2,12,15)(H2,13,16)
InChIKeyHVUNEICOGCOCHG-UHFFFAOYSA-N
XLogP-0.92
TPSA132.35 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 5-0.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[(4-tert-butylphenyl)sulfonylamino]pentanediamide
CID 25197502
(2S)-2-[(3,4-dichlorophenyl)sulfonylamino]pentanediamide
CID 131855550
(2S)-2-(benzenesulfonamido)-5-(diaminomethylideneamino)pentanamide
CID 40548649
(2R)-5-amino-2-[(4-fluorophenyl)sulfonylamino]-5-oxopentanoate
CID 9403798
4-[(1-amino-1-oxo-4-phenylbutan-2-yl)sulfamoyl]benzamide
CID 18513137
(2S)-5-amino-2-[(3-methoxyphenyl)sulfonylamino]-5-oxopentanoic acid
CID 81264713
(2S)-5-amino-2-[(3-cyanophenyl)sulfonylamino]-5-oxopentanoic acid
CID 28527492
(2S)-2-(benzenesulfonamido)-5-(methylamino)-5-oxopentanoic acid
CID 131860438
4-(benzenesulfonamido)-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid
CID 22975704
(2R)-5-amino-2-[(3,4-dichlorophenyl)sulfonylamino]-5-oxopentanoic acid
CID 104935542
(2R)-2-(benzenesulfonamido)propanamide
CID 970705
2-[(4-methylphenyl)sulfonylamino]-3-phenylpropanamide
CID 3690831

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonamido)pentanediamide?
The IUPAC name of 2-(benzenesulfonamido)pentanediamide (CID 71384470) is 2-(benzenesulfonamido)pentanediamide.
What is the SMILES notation for 2-(benzenesulfonamido)pentanediamide?
The canonical SMILES for 2-(benzenesulfonamido)pentanediamide is NC(=O)CCC(NS(=O)(=O)c1ccccc1)C(N)=O.
What is the InChIKey of 2-(benzenesulfonamido)pentanediamide?
The InChIKey is HVUNEICOGCOCHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O4S/c12-10(15)7-6-9(11(13)16)14-19(17,18)8-4-2-1-3-5-8/h1-5,9,14H,6-7H2,(H2,12,15)(H2,13,16).
What are the key properties of 2-(benzenesulfonamido)pentanediamide?
2-(benzenesulfonamido)pentanediamide has a molecular weight of 285.32 g/mol, XLogP of -0.92, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonamido)pentanediamide is sourced from PubChem (CID 71384470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).