N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide

C14H17N3O3S2 — CID 154780639

IUPACN-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1S(=O)(=O)c1cnc2ccsc2c1
InChIInChI=1S/C14H17N3O3S2/c1-15-14(18)12-4-2-3-6-17(12)22(19,20)10-8-13-11(16-9-10)5-7-21-13/h5,7-9,12H,2-4,6H2,1H3,(H,15,18)
InChIKeyIADNDRLHLBZYKE-UHFFFAOYSA-N
MW339.44 g/mol
LogP1.59
Rot. Bonds3

About N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide

N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide (PubChem CID 154780639) has the molecular formula C14H17N3O3S2 and a molecular weight of 339.44 g/mol. Its IUPAC name is N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide
PubChem CID154780639
Molecular FormulaC14H17N3O3S2
Molecular Weight339.44 g/mol
Exact Mass339.07
IUPAC NameN-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide
SMILESCNC(=O)C1CCCCN1S(=O)(=O)c1cnc2ccsc2c1
InChIInChI=1S/C14H17N3O3S2/c1-15-14(18)12-4-2-3-6-17(12)22(19,20)10-8-13-11(16-9-10)5-7-21-13/h5,7-9,12H,2-4,6H2,1H3,(H,15,18)
InChIKeyIADNDRLHLBZYKE-UHFFFAOYSA-N
XLogP1.59
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.44
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(2-chloro-1,3-thiazol-5-yl)sulfonyl]-N-methylpiperidine-2-carboxamide
CID 61046496
1-(2-amino-4-methylphenyl)sulfonyl-N-methylpiperidine-2-carboxamide
CID 61112037
1-[4-(bromomethyl)phenyl]sulfonyl-N-methylpiperidine-2-carboxamide
CID 65480615
1-(4-bromo-3-fluorophenyl)sulfonyl-N-methylpiperidine-2-carboxamide
CID 103697332
N-methyl-1-(1-phenylpyrazol-4-yl)sulfonylpiperidine-2-carboxamide
CID 51094154
N-methyl-1-[3-(trifluoromethyl)phenyl]sulfonylpiperidine-2-carboxamide
CID 47026868
(2S)-1-(4-fluorophenyl)sulfonyl-N-methylpiperidine-2-carbothioamide;(2S)-1-(4-fluorophenyl)sulfonyl-N-methylpiperidine-2-carboxamide
CID 157080497
1-(5-amino-2-chlorophenyl)sulfonyl-N-methylpiperidine-2-carboxamide
CID 61113715
1-(3,4-dimethoxyphenyl)sulfonyl-N-methylpyrrolidine-2-carboxamide
CID 18846703
(2S)-N-methyl-1-[4-(2,2,2-trifluoroethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide
CID 52510874
(2R)-N-methyl-1-[4-(2,2,2-trifluoroethoxy)phenyl]sulfonylpyrrolidine-2-carboxamide
CID 52510875
(2S)-1-(4-methylphenyl)sulfonyl-N-quinolin-3-ylpiperidine-2-carboxamide
CID 25353300

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide?
The IUPAC name of N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide (CID 154780639) is N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide.
What is the SMILES notation for N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide?
The canonical SMILES for N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide is CNC(=O)C1CCCCN1S(=O)(=O)c1cnc2ccsc2c1.
What is the InChIKey of N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide?
The InChIKey is IADNDRLHLBZYKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S2/c1-15-14(18)12-4-2-3-6-17(12)22(19,20)10-8-13-11(16-9-10)5-7-21-13/h5,7-9,12H,2-4,6H2,1H3,(H,15,18).
What are the key properties of N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide?
N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide has a molecular weight of 339.44 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-thieno[3,2-b]pyridin-6-ylsulfonylpiperidine-2-carboxamide is sourced from PubChem (CID 154780639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).