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

C17H26N2O3S2 — CID 2330102

IUPACN-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
SMILESCN(C(=O)C1CCN(S(=O)(=O)c2cccs2)CC1)C1CCCCC1
InChIInChI=1S/C17H26N2O3S2/c1-18(15-6-3-2-4-7-15)17(20)14-9-11-19(12-10-14)24(21,22)16-8-5-13-23-16/h5,8,13-15H,2-4,6-7,9-12H2,1H3
InChIKeyPWFSPRUFEBPLOT-UHFFFAOYSA-N
MW370.54 g/mol
LogP2.94
Rot. Bonds4

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

N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide (PubChem CID 2330102) has the molecular formula C17H26N2O3S2 and a molecular weight of 370.54 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
PubChem CID2330102
Molecular FormulaC17H26N2O3S2
Molecular Weight370.54 g/mol
Exact Mass370.14
IUPAC NameN-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
SMILESCN(C(=O)C1CCN(S(=O)(=O)c2cccs2)CC1)C1CCCCC1
InChIInChI=1S/C17H26N2O3S2/c1-18(15-6-3-2-4-7-15)17(20)14-9-11-19(12-10-14)24(21,22)16-8-5-13-23-16/h5,8,13-15H,2-4,6-7,9-12H2,1H3
InChIKeyPWFSPRUFEBPLOT-UHFFFAOYSA-N
XLogP2.94
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.54
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide (CID 2330102) is N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide is CN(C(=O)C1CCN(S(=O)(=O)c2cccs2)CC1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The InChIKey is PWFSPRUFEBPLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O3S2/c1-18(15-6-3-2-4-7-15)17(20)14-9-11-19(12-10-14)24(21,22)16-8-5-13-23-16/h5,8,13-15H,2-4,6-7,9-12H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide has a molecular weight of 370.54 g/mol, XLogP of 2.94, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 2330102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).