[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone

C15H24N4O3S — CID 3241075

IUPAC[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)C2CCN(S(=O)(=O)c3cnc[nH]3)CC2)CC1
InChIInChI=1S/C15H24N4O3S/c1-12-2-6-18(7-3-12)15(20)13-4-8-19(9-5-13)23(21,22)14-10-16-11-17-14/h10-13H,2-9H2,1H3,(H,16,17)
InChIKeyNHSLWRDISLYORN-UHFFFAOYSA-N
MW340.45 g/mol
LogP1.07
Rot. Bonds3

About [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone

[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone (PubChem CID 3241075) has the molecular formula C15H24N4O3S and a molecular weight of 340.45 g/mol. Its IUPAC name is [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone
PubChem CID3241075
Molecular FormulaC15H24N4O3S
Molecular Weight340.45 g/mol
Exact Mass340.16
IUPAC Name[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone
SMILESCC1CCN(C(=O)C2CCN(S(=O)(=O)c3cnc[nH]3)CC2)CC1
InChIInChI=1S/C15H24N4O3S/c1-12-2-6-18(7-3-12)15(20)13-4-8-19(9-5-13)23(21,22)14-10-16-11-17-14/h10-13H,2-9H2,1H3,(H,16,17)
InChIKeyNHSLWRDISLYORN-UHFFFAOYSA-N
XLogP1.07
TPSA86.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1H-imidazol-5-ylsulfonyl)-4-methylpiperidine
CID 6621960
N-cycloheptyl-1-(1H-imidazol-4-ylsulfonyl)piperidine-4-carboxamide
CID 15998160
N~2~-(1H-imidazol-4-ylsulfonyl)-N~2~-methyl-N~1~-(4-methylcyclohexyl)glycinamide
CID 16188110
N-(2-cyclohex-1-en-1-ylethyl)-1-(1H-imidazol-4-ylsulfonyl)piperidine-4-carboxamide
CID 3236723
ethyl 1-{[1-(1H-imidazol-4-ylsulfonyl)piperidin-4-yl]carbonyl}piperidine-3-carboxylate
CID 3244499
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-(2,3-dimethylcyclohexyl)-1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carboxamide
CID 20856449
methyl 2-[[1-(1H-imidazol-5-ylsulfonyl)piperidine-4-carbonyl]amino]acetate
CID 20856458
1-(1H-imidazol-5-ylsulfonyl)-3,5-dimethylpiperidine
CID 20856403
1-{[1-(1H-imidazol-4-ylsulfonyl)piperidin-4-yl]carbonyl}-4-methylpiperazine
CID 3241121

Frequently Asked Questions

What is the IUPAC name of [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone?
The IUPAC name of [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone (CID 3241075) is [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone.
What is the SMILES notation for [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone?
The canonical SMILES for [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone is CC1CCN(C(=O)C2CCN(S(=O)(=O)c3cnc[nH]3)CC2)CC1.
What is the InChIKey of [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone?
The InChIKey is NHSLWRDISLYORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O3S/c1-12-2-6-18(7-3-12)15(20)13-4-8-19(9-5-13)23(21,22)14-10-16-11-17-14/h10-13H,2-9H2,1H3,(H,16,17).
What are the key properties of [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone?
[1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone has a molecular weight of 340.45 g/mol, XLogP of 1.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1H-imidazol-5-ylsulfonyl)piperidin-4-yl]-(4-methylpiperidin-1-yl)methanone is sourced from PubChem (CID 3241075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).