N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide

C16H24N2O3S2 — CID 2088500

IUPACN-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
SMILESO=C(NC1CCCCC1)C1CCN(S(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C16H24N2O3S2/c19-16(17-14-5-2-1-3-6-14)13-8-10-18(11-9-13)23(20,21)15-7-4-12-22-15/h4,7,12-14H,1-3,5-6,8-11H2,(H,17,19)
InChIKeyDGNKLXSLWGUNNE-UHFFFAOYSA-N
MW356.51 g/mol
LogP2.60
Rot. Bonds4

About N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide

N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide (PubChem CID 2088500) has the molecular formula C16H24N2O3S2 and a molecular weight of 356.51 g/mol. Its IUPAC name is N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
PubChem CID2088500
Molecular FormulaC16H24N2O3S2
Molecular Weight356.51 g/mol
Exact Mass356.12
IUPAC NameN-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
SMILESO=C(NC1CCCCC1)C1CCN(S(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C16H24N2O3S2/c19-16(17-14-5-2-1-3-6-14)13-8-10-18(11-9-13)23(20,21)15-7-4-12-22-15/h4,7,12-14H,1-3,5-6,8-11H2,(H,17,19)
InChIKeyDGNKLXSLWGUNNE-UHFFFAOYSA-N
XLogP2.60
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.51
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclohexyl-1-(thien-2-ylsulfonyl)piperidine-3-carboxamide
CID 3243927
N-Cycloheptyl-1-(thiophene-2-sulfonyl)piperidine-4-carboxamide
CID 2053793
(4-Methylpiperidin-1-yl)-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone
CID 2091610
N-isopropyl-1-(2-thienylsulfonyl)-3-piperidinecarboxamide
CID 3239956
1-{[1-(Thien-2-ylsulfonyl)piperidin-4-yl]carbonyl}azepane
CID 3244621
N-(butan-2-yl)-1-(thiophen-2-ylsulfonyl)piperidine-4-carboxamide
CID 3690861
N-(2-methylbutan-2-yl)-1-(thiophen-2-ylsulfonyl)piperidine-4-carboxamide
CID 2089592
N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 2330102
N-(pentan-3-yl)-1-(thiophen-2-ylsulfonyl)piperidine-4-carboxamide
CID 2409473
1-(5-bromothiophen-2-yl)sulfonyl-N-cycloheptylpiperidine-4-carboxamide
CID 4050954
N-cyclopentyl-4-[(thiophen-2-ylsulfonylamino)methyl]cyclohexane-1-carboxamide
CID 4075418
1-(5-bromothiophen-2-yl)sulfonyl-N-butan-2-ylpiperidine-4-carboxamide
CID 4118418

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide (CID 2088500) is N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide is O=C(NC1CCCCC1)C1CCN(S(=O)(=O)c2cccs2)CC1.
What is the InChIKey of N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The InChIKey is DGNKLXSLWGUNNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3S2/c19-16(17-14-5-2-1-3-6-14)13-8-10-18(11-9-13)23(20,21)15-7-4-12-22-15/h4,7,12-14H,1-3,5-6,8-11H2,(H,17,19).
What are the key properties of N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide has a molecular weight of 356.51 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 2088500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).