N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide

C11H18N4O3S — CID 115627036

IUPACN-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide
SMILESO=C(CCNS(=O)(=O)c1cnc[nH]1)N1CCCCC1
InChIInChI=1S/C11H18N4O3S/c16-11(15-6-2-1-3-7-15)4-5-14-19(17,18)10-8-12-9-13-10/h8-9,14H,1-7H2,(H,12,13)
InChIKeyBRKGQDFXUFITBM-UHFFFAOYSA-N
MW286.36 g/mol
LogP0.09
Rot. Bonds5

About N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide

N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide (PubChem CID 115627036) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide.

Molecular Properties

Compound NameN-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide
PubChem CID115627036
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC NameN-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide
SMILESO=C(CCNS(=O)(=O)c1cnc[nH]1)N1CCCCC1
InChIInChI=1S/C11H18N4O3S/c16-11(15-6-2-1-3-7-15)4-5-14-19(17,18)10-8-12-9-13-10/h8-9,14H,1-7H2,(H,12,13)
InChIKeyBRKGQDFXUFITBM-UHFFFAOYSA-N
XLogP0.09
TPSA95.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-1-(1H-imidazol-4-ylsulfonyl)piperidine-4-carboxamide
CID 15998160
N~1~-cycloheptyl-N~2~-(1H-imidazol-4-ylsulfonyl)-N~2~-methylglycinamide
CID 16189353
N-(2-ethylhexyl)-1-(1H-imidazol-4-ylsulfonyl)-3-piperidinecarboxamide
CID 5307411
N-cycloheptyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide
CID 5308846
N-cyclohexyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide
CID 5308847
N~1~-cyclopentyl-N~2~-(1H-imidazol-4-ylsulfonyl)-N~2~-methylglycinamide
CID 6620231
N~1~-cyclooctyl-N~2~-(1H-imidazol-4-ylsulfonyl)-N~2~-methylglycinamide
CID 16189354
1-(1H-imidazol-5-ylsulfonyl)-3,5-dimethylpiperidine
CID 20856403
1-{[1-(1H-imidazol-4-ylsulfonyl)piperidin-4-yl]carbonyl}-4-methylpiperazine
CID 3241121
N-butyl-1-(1H-imidazol-4-ylsulfonyl)piperidine-4-carboxamide
CID 3238989
1-(1H-imidazol-4-ylsulfonyl)-4-[(4-methylpiperidin-1-yl)carbonyl]piperidine
CID 3241075
N-cyclooctyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide
CID 5308293

Frequently Asked Questions

What is the IUPAC name of N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide?
The IUPAC name of N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide (CID 115627036) is N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide.
What is the SMILES notation for N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide?
The canonical SMILES for N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide is O=C(CCNS(=O)(=O)c1cnc[nH]1)N1CCCCC1.
What is the InChIKey of N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide?
The InChIKey is BRKGQDFXUFITBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c16-11(15-6-2-1-3-7-15)4-5-14-19(17,18)10-8-12-9-13-10/h8-9,14H,1-7H2,(H,12,13).
What are the key properties of N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide?
N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide has a molecular weight of 286.36 g/mol, XLogP of 0.09, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-oxo-3-piperidin-1-ylpropyl)-1H-imidazole-5-sulfonamide is sourced from PubChem (CID 115627036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).