N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide

C14H22N2O3S2 — CID 7914403

IUPACN-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
SMILESCC(C)(C)NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C14H22N2O3S2/c1-14(2,3)15-13(17)11-6-8-16(9-7-11)21(18,19)12-5-4-10-20-12/h4-5,10-11H,6-9H2,1-3H3,(H,15,17)
InChIKeyIUQYFNVTQBSVAH-UHFFFAOYSA-N
MW330.48 g/mol
LogP2.06
Rot. Bonds3

About N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide

N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide (PubChem CID 7914403) has the molecular formula C14H22N2O3S2 and a molecular weight of 330.48 g/mol. Its IUPAC name is N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
PubChem CID7914403
Molecular FormulaC14H22N2O3S2
Molecular Weight330.48 g/mol
Exact Mass330.11
IUPAC NameN-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
SMILESCC(C)(C)NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1
InChIInChI=1S/C14H22N2O3S2/c1-14(2,3)15-13(17)11-6-8-16(9-7-11)21(18,19)12-5-4-10-20-12/h4-5,10-11H,6-9H2,1-3H3,(H,15,17)
InChIKeyIUQYFNVTQBSVAH-UHFFFAOYSA-N
XLogP2.06
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide 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-thiophen-2-ylsulfonyl-N-(2,4,4-trimethylpentan-2-yl)piperidine-4-carboxamide
CID 51188882
1-tert-butyl-3-(1-thiophen-2-ylsulfonylpiperidin-4-yl)urea
CID 110823258
N-[(2S)-3-methylbutan-2-yl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 27511485
N-(2-methyl-1-thiophen-2-ylpropyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 17462186
1-tert-butyl-2-[(1-thiophen-2-ylsulfonylpyrrolidin-3-yl)methyl]guanidine;hydroiodide
CID 120973090
N-(4-bromophenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 4810583
N-(4-iodophenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 2388200
N-(3,5-dimethoxyphenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 7960898
N'-(furan-2-carbonyl)-1-thiophen-2-ylsulfonylpiperidine-4-carbohydrazide
CID 9477271
N-(2-piperidin-1-ylsulfonylphenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 55920459
N-[(4-methylphenyl)methyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 4810492
N-[(1R)-1-(4-methylsulfonylphenyl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 26468180

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide (CID 7914403) is N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide is CC(C)(C)NC(=O)C1CCN(S(=O)(=O)c2cccs2)CC1.
What is the InChIKey of N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The InChIKey is IUQYFNVTQBSVAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3S2/c1-14(2,3)15-13(17)11-6-8-16(9-7-11)21(18,19)12-5-4-10-20-12/h4-5,10-11H,6-9H2,1-3H3,(H,15,17).
What are the key properties of N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide has a molecular weight of 330.48 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 7914403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).