N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide

C10H14N4O4S — CID 138467543

IUPACN-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide
SMILESCN(C1CCC(=O)NC1=O)S(=O)(=O)c1cn(C)cn1
InChIInChI=1S/C10H14N4O4S/c1-13-5-9(11-6-13)19(17,18)14(2)7-3-4-8(15)12-10(7)16/h5-7H,3-4H2,1-2H3,(H,12,15,16)
InChIKeyLZSMUFPOJOHYNS-UHFFFAOYSA-N
MW286.31 g/mol
LogP-1.15
Rot. Bonds3

About N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide

N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide (PubChem CID 138467543) has the molecular formula C10H14N4O4S and a molecular weight of 286.31 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide
PubChem CID138467543
Molecular FormulaC10H14N4O4S
Molecular Weight286.31 g/mol
Exact Mass286.07
IUPAC NameN-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide
SMILESCN(C1CCC(=O)NC1=O)S(=O)(=O)c1cn(C)cn1
InChIInChI=1S/C10H14N4O4S/c1-13-5-9(11-6-13)19(17,18)14(2)7-3-4-8(15)12-10(7)16/h5-7H,3-4H2,1-2H3,(H,12,15,16)
InChIKeyLZSMUFPOJOHYNS-UHFFFAOYSA-N
XLogP-1.15
TPSA101.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 5-1.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-1-(1-propan-2-ylimidazol-4-yl)sulfonylpiperidine-4-carboxamide
CID 53007816
[(2S,4S)-4-fluoro-1-(1-methylimidazol-4-yl)sulfonylpyrrolidin-2-yl]-piperidin-1-ylmethanone
CID 110875946
N-cyclohexyl-1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
CID 110199949
5-(1-Methylimidazol-4-yl)sulfonyl-9-(4-methylpiperazine-1-carbonyl)-1,5-diazacycloundecan-2-one
CID 110199971
5-[(1-Methyl-1H-imidazol-4-YL)sulfonyl]-9-[4-(2-methylpropyl)piperazine-1-carbonyl]-1,5-diazacycloundecan-2-one
CID 110199983
1-[(1-Methyl-1H-imidazol-4-YL)sulfonyl]-N-[3-(4-methylpiperidin-1-YL)propyl]-4-oxo-1,5-diazacycloundecane-8-carboxamide
CID 110200120
5-({1-[(1-methyl-1H-imidazol-4-yl)sulfonyl]-4-piperidyl}carbonyl)-1,5-diazacycloundecan-2-one
CID 110201733
N-(2,6-dioxo-3-piperidinyl)-1-methyl-1H-Imidazole-4-sulfonamide
CID 65969855
2-[(1-methylimidazol-4-yl)sulfonylamino]-N-(3,3,3-trifluoro-2-piperazin-1-ylpropyl)acetamide
CID 120812307
(2S,4R)-4-fluoro-1-[1-(2-methylpropyl)imidazol-4-yl]sulfonylpyrrolidine-2-carboxamide
CID 120916446
(4,4-Difluoropyrrolidin-2-yl)-[4-(1,2-dimethylimidazol-4-yl)sulfonylpiperazin-1-yl]methanone;hydrochloride
CID 120955000
(4,4-Difluoropyrrolidin-2-yl)-[4-(1,2-dimethylimidazol-4-yl)sulfonylpiperazin-1-yl]methanone
CID 120955001

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide (CID 138467543) is N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide is CN(C1CCC(=O)NC1=O)S(=O)(=O)c1cn(C)cn1.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide?
The InChIKey is LZSMUFPOJOHYNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O4S/c1-13-5-9(11-6-13)19(17,18)14(2)7-3-4-8(15)12-10(7)16/h5-7H,3-4H2,1-2H3,(H,12,15,16).
What are the key properties of N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide?
N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide has a molecular weight of 286.31 g/mol, XLogP of -1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)-N,1-dimethylimidazole-4-sulfonamide is sourced from PubChem (CID 138467543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).