N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide

C11H18N4O3S — CID 6620231

IUPACN-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide
SMILESCN(CC(=O)NC1CCCC1)S(=O)(=O)c1cnc[nH]1
InChIInChI=1S/C11H18N4O3S/c1-15(19(17,18)11-6-12-8-13-11)7-10(16)14-9-4-2-3-5-9/h6,8-9H,2-5,7H2,1H3,(H,12,13)(H,14,16)
InChIKeyLLIRJIYMEKQPKT-UHFFFAOYSA-N
MW286.36 g/mol
LogP0.09
Rot. Bonds5

About N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide

N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide (PubChem CID 6620231) has the molecular formula C11H18N4O3S and a molecular weight of 286.36 g/mol. Its IUPAC name is N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide
PubChem CID6620231
Molecular FormulaC11H18N4O3S
Molecular Weight286.36 g/mol
Exact Mass286.11
IUPAC NameN-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide
SMILESCN(CC(=O)NC1CCCC1)S(=O)(=O)c1cnc[nH]1
InChIInChI=1S/C11H18N4O3S/c1-15(19(17,18)11-6-12-8-13-11)7-10(16)14-9-4-2-3-5-9/h6,8-9H,2-5,7H2,1H3,(H,12,13)(H,14,16)
InChIKeyLLIRJIYMEKQPKT-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~2~-(1H-imidazol-4-ylsulfonyl)-N~2~-methyl-N~1~-(4-methylcyclohexyl)glycinamide
CID 16188110
N~1~-cycloheptyl-N~2~-(1H-imidazol-4-ylsulfonyl)-N~2~-methylglycinamide
CID 16189353
N~1~-(2,3-dimethylcyclohexyl)-N~2~-(1H-imidazol-4-ylsulfonyl)-N~2~-methylglycinamide
CID 6620268
N~1~-cyclooctyl-N~2~-(1H-imidazol-4-ylsulfonyl)-N~2~-methylglycinamide
CID 16189354
N-butyl-1-(1H-imidazol-4-ylsulfonyl)piperidine-4-carboxamide
CID 3238989
N-cyclopentyl-1-(1H-imidazol-5-ylsulfonyl)piperidine-3-carboxamide
CID 5308473
2-((1-((1H-imidazol-4-yl)sulfonyl)piperidin-4-yl)sulfonyl)-N-methylacetamide
CID 71809157
2-[methyl-[(2-methyl-1H-imidazol-5-yl)sulfonyl]amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 64149277
2-[(2-ethyl-1H-imidazol-5-yl)sulfonyl-methylamino]-N-(2,2,2-trifluoroethyl)acetamide
CID 64149278
2-[1H-imidazol-5-ylsulfonyl(methyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 64153597
2-[1H-imidazol-5-ylsulfonyl(2,2,2-trifluoroethyl)amino]-N,N-dimethylacetamide
CID 64155149
1-(1H-imidazol-5-ylsulfonyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 128059629

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide (CID 6620231) is N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide is CN(CC(=O)NC1CCCC1)S(=O)(=O)c1cnc[nH]1.
What is the InChIKey of N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide?
The InChIKey is LLIRJIYMEKQPKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3S/c1-15(19(17,18)11-6-12-8-13-11)7-10(16)14-9-4-2-3-5-9/h6,8-9H,2-5,7H2,1H3,(H,12,13)(H,14,16).
What are the key properties of N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide?
N-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide 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-cyclopentyl-2-[1H-imidazol-5-ylsulfonyl(methyl)amino]acetamide is sourced from PubChem (CID 6620231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).