N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide

C10H16N4O4S — CID 90647276

IUPACN-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide
SMILESCS(=O)(=O)NC1CCN(C(=O)c2c[nH]c(=O)[nH]2)CC1
InChIInChI=1S/C10H16N4O4S/c1-19(17,18)13-7-2-4-14(5-3-7)9(15)8-6-11-10(16)12-8/h6-7,13H,2-5H2,1H3,(H2,11,12,16)
InChIKeyOFHIQJWFGGYDEH-UHFFFAOYSA-N
MW288.33 g/mol
LogP-1.14
Rot. Bonds3

About N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide

N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide (PubChem CID 90647276) has the molecular formula C10H16N4O4S and a molecular weight of 288.33 g/mol. Its IUPAC name is N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide
PubChem CID90647276
Molecular FormulaC10H16N4O4S
Molecular Weight288.33 g/mol
Exact Mass288.09
IUPAC NameN-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide
SMILESCS(=O)(=O)NC1CCN(C(=O)c2c[nH]c(=O)[nH]2)CC1
InChIInChI=1S/C10H16N4O4S/c1-19(17,18)13-7-2-4-14(5-3-7)9(15)8-6-11-10(16)12-8/h6-7,13H,2-5H2,1H3,(H2,11,12,16)
InChIKeyOFHIQJWFGGYDEH-UHFFFAOYSA-N
XLogP-1.14
TPSA115.13 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 5-1.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide?
The IUPAC name of N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide (CID 90647276) is N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide.
What is the SMILES notation for N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide?
The canonical SMILES for N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide is CS(=O)(=O)NC1CCN(C(=O)c2c[nH]c(=O)[nH]2)CC1.
What is the InChIKey of N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide?
The InChIKey is OFHIQJWFGGYDEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O4S/c1-19(17,18)13-7-2-4-14(5-3-7)9(15)8-6-11-10(16)12-8/h6-7,13H,2-5H2,1H3,(H2,11,12,16).
What are the key properties of N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide?
N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide has a molecular weight of 288.33 g/mol, XLogP of -1.14, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-oxo-1,3-dihydroimidazole-4-carbonyl)piperidin-4-yl]methanesulfonamide is sourced from PubChem (CID 90647276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).