N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide

C14H17N3O3S3 — CID 91836688

IUPACN-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide
SMILESO=C(CNS(=O)(=O)c1cccs1)N1CCCCC1c1nccs1
InChIInChI=1S/C14H17N3O3S3/c18-12(10-16-23(19,20)13-5-3-8-21-13)17-7-2-1-4-11(17)14-15-6-9-22-14/h3,5-6,8-9,11,16H,1-2,4,7,10H2
InChIKeyDEHVVXOXGBMQBN-UHFFFAOYSA-N
MW371.51 g/mol
LogP2.24
Rot. Bonds5

About N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide

N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide (PubChem CID 91836688) has the molecular formula C14H17N3O3S3 and a molecular weight of 371.51 g/mol. Its IUPAC name is N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide
PubChem CID91836688
Molecular FormulaC14H17N3O3S3
Molecular Weight371.51 g/mol
Exact Mass371.04
IUPAC NameN-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide
SMILESO=C(CNS(=O)(=O)c1cccs1)N1CCCCC1c1nccs1
InChIInChI=1S/C14H17N3O3S3/c18-12(10-16-23(19,20)13-5-3-8-21-13)17-7-2-1-4-11(17)14-15-6-9-22-14/h3,5-6,8-9,11,16H,1-2,4,7,10H2
InChIKeyDEHVVXOXGBMQBN-UHFFFAOYSA-N
XLogP2.24
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.51
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazecan-1-yl)ethyl]thiophene-2-sulfonamide
CID 110200289
N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]-5-phenyl-1,2-oxazole-3-carboxamide
CID 86957488
(3R)-3-phenyl-1-[(2S)-2-(1,3-thiazol-2-yl)piperidin-1-yl]butan-1-one
CID 95770134
methyl 4-oxo-4-[2-(1,3-thiazol-2-yl)pyrrolidin-1-yl]butanoate
CID 110750323
2-(1,3-thiazol-2-yl)piperidine-1-carboxamide
CID 66584691
2-(4-methylphenyl)-1-[(2S)-2-(1,3-thiazol-2-yl)piperidin-1-yl]ethanone
CID 95761217
N-[2-[2-(1-methylimidazol-2-yl)piperazin-1-yl]-2-oxoethyl]thiophene-2-sulfonamide
CID 120879894
2-(4-pyrimidin-2-ylpiperazin-1-yl)-1-[(2R)-2-(1,3-thiazol-2-yl)piperidin-1-yl]ethanone
CID 97191446
N-[2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]thiophene-2-sulfonamide
CID 22583185
N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]thiophene-2-sulfonamide;hydrochloride
CID 119491037
2-(1-propan-2-ylpiperidin-4-yl)-1-[(2R)-2-(1,3-thiazol-2-yl)piperidin-1-yl]ethanone
CID 97200306
3-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]-1,3-oxazolidin-2-one
CID 72915818

Frequently Asked Questions

What is the IUPAC name of N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide (CID 91836688) is N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide is O=C(CNS(=O)(=O)c1cccs1)N1CCCCC1c1nccs1.
What is the InChIKey of N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide?
The InChIKey is DEHVVXOXGBMQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S3/c18-12(10-16-23(19,20)13-5-3-8-21-13)17-7-2-1-4-11(17)14-15-6-9-22-14/h3,5-6,8-9,11,16H,1-2,4,7,10H2.
What are the key properties of N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide?
N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide has a molecular weight of 371.51 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-oxo-2-[2-(1,3-thiazol-2-yl)piperidin-1-yl]ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 91836688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).