N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide

C16H19N3O3S2 — CID 3238348

IUPACN-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
SMILESCc1cccc(NC(=O)C2CCN(S(=O)(=O)c3cccs3)CC2)n1
InChIInChI=1S/C16H19N3O3S2/c1-12-4-2-5-14(17-12)18-16(20)13-7-9-19(10-8-13)24(21,22)15-6-3-11-23-15/h2-6,11,13H,7-10H2,1H3,(H,17,18,20)
InChIKeyZZYUECRVTMOFHW-UHFFFAOYSA-N
MW365.48 g/mol
LogP2.49
Rot. Bonds4

About N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide

N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide (PubChem CID 3238348) has the molecular formula C16H19N3O3S2 and a molecular weight of 365.48 g/mol. Its IUPAC name is N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
PubChem CID3238348
Molecular FormulaC16H19N3O3S2
Molecular Weight365.48 g/mol
Exact Mass365.09
IUPAC NameN-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
SMILESCc1cccc(NC(=O)C2CCN(S(=O)(=O)c3cccs3)CC2)n1
InChIInChI=1S/C16H19N3O3S2/c1-12-4-2-5-14(17-12)18-16(20)13-7-9-19(10-8-13)24(21,22)15-6-3-11-23-15/h2-6,11,13H,7-10H2,1H3,(H,17,18,20)
InChIKeyZZYUECRVTMOFHW-UHFFFAOYSA-N
XLogP2.49
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-bromo-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 2314215
2-[3-Amino-6-methyl-2-oxo-4-(thiophene-2-sulfonyl)-2H-pyridin-1-yl]-N-(6-amino-2-methyl-pyridin-3-ylmethyl)-acetamide
CID 44281595
N-(4-chloro-2-pyridinyl)-1-(2-thienylsulfonyl)-4-piperidinecarboxamide
CID 1190394
N-(5-chloro-2-pyridinyl)-1-(2-thienylsulfonyl)-4-piperidinecarboxamide
CID 2082265
N-[4-(4-acetamidophenyl)-1,3-thiazol-2-yl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 2550042
N-(pyridin-2-ylmethyl)-1-(thien-2-ylsulfonyl)piperidine-4-carboxamide
CID 3239635
3-(benzenesulfonyl)-N-(6-methylpyridin-2-yl)propanamide
CID 3163455
N-(3-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 2307845
N-(4-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 2315676
N-cyclohexyl-N-pyridin-2-yl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 5053355
N-[4-[6-methyl-5-(thiophen-3-ylsulfonylamino)-3-pyridinyl]-2-pyridinyl]acetamide
CID 118293587
N-pyridin-2-yl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide
CID 1535318

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide (CID 3238348) is N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide is Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3cccs3)CC2)n1.
What is the InChIKey of N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
The InChIKey is ZZYUECRVTMOFHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3S2/c1-12-4-2-5-14(17-12)18-16(20)13-7-9-19(10-8-13)24(21,22)15-6-3-11-23-15/h2-6,11,13H,7-10H2,1H3,(H,17,18,20).
What are the key properties of N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide?
N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide has a molecular weight of 365.48 g/mol, XLogP of 2.49, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-pyridinyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 3238348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).