N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide

C18H19NO2S2 — CID 91599372

IUPACN-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NC1C2CCC3C(c4ccccc4C2)C31)c1cccs1
InChIInChI=1S/C18H19NO2S2/c20-23(21,15-6-3-9-22-15)19-18-12-7-8-14-16(17(14)18)13-5-2-1-4-11(13)10-12/h1-6,9,12,14,16-19H,7-8,10H2
InChIKeyOIYOMLIPLQLRME-UHFFFAOYSA-N
MW345.49 g/mol
LogP3.39
Rot. Bonds3

About N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide

N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide (PubChem CID 91599372) has the molecular formula C18H19NO2S2 and a molecular weight of 345.49 g/mol. Its IUPAC name is N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide
PubChem CID91599372
Molecular FormulaC18H19NO2S2
Molecular Weight345.49 g/mol
Exact Mass345.09
IUPAC NameN-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide
SMILESO=S(=O)(NC1C2CCC3C(c4ccccc4C2)C31)c1cccs1
InChIInChI=1S/C18H19NO2S2/c20-23(21,15-6-3-9-22-15)19-18-12-7-8-14-16(17(14)18)13-5-2-1-4-11(13)10-12/h1-6,9,12,14,16-19H,7-8,10H2
InChIKeyOIYOMLIPLQLRME-UHFFFAOYSA-N
XLogP3.39
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.49
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide with MolForge

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Related Compounds

N-[(1R,2S)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]thiophene-2-sulfonamide
CID 103825580
N-(13-tricyclo[8.2.1.03,8]trideca-3,5,7-trienylmethyl)thiophene-2-sulfonamide
CID 91354078
ethane;2-phenyl-N-[(1R,10S,13R)-13-(thiophen-2-ylsulfonylamino)-5-tricyclo[8.2.1.03,8]trideca-3(8),4,6-trienyl]acetamide
CID 159627381
N-[(1R,1aS,6aS)-1,1a,6,6a-tetrahydrocyclopropa[a]inden-1-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 124590673
N-(1-methylsulfonylpyrrolidin-3-yl)thiophene-2-sulfonamide
CID 110871311
N-(2-aminocycloheptyl)thiophene-2-sulfonamide
CID 63258931
N-(dicyclopropylmethyl)thiophene-2-sulfonamide
CID 31846779
N-(6-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl)thiophene-2-sulfonamide
CID 73133417
2-(thiophen-2-ylsulfonylamino)cyclopentane-1-carboxylic acid
CID 64816831
N-[(3R)-piperidin-3-yl]thiophene-2-sulfonamide
CID 71645820
N-thiophen-2-ylsulfonylcyclopropanecarboxamide
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2-thiophen-2-ylsulfonylsulfonylthiophene
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Frequently Asked Questions

What is the IUPAC name of N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide?
The IUPAC name of N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide (CID 91599372) is N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide?
The canonical SMILES for N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide is O=S(=O)(NC1C2CCC3C(c4ccccc4C2)C31)c1cccs1.
What is the InChIKey of N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide?
The InChIKey is OIYOMLIPLQLRME-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2S2/c20-23(21,15-6-3-9-22-15)19-18-12-7-8-14-16(17(14)18)13-5-2-1-4-11(13)10-12/h1-6,9,12,14,16-19H,7-8,10H2.
What are the key properties of N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide?
N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide has a molecular weight of 345.49 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(14-tetracyclo[8.3.1.02,13.03,8]tetradeca-3,5,7-trienyl)thiophene-2-sulfonamide is sourced from PubChem (CID 91599372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).