N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide

C16H14N2O3S2 — CID 39839792

IUPACN-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(OCc2ccccn2)c1)c1cccs1
InChIInChI=1S/C16H14N2O3S2/c19-23(20,16-8-4-10-22-16)18-13-6-3-7-15(11-13)21-12-14-5-1-2-9-17-14/h1-11,18H,12H2
InChIKeyZSEQAKUGOIISLR-UHFFFAOYSA-N
MW346.43 g/mol
LogP3.52
Rot. Bonds6

About N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide

N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide (PubChem CID 39839792) has the molecular formula C16H14N2O3S2 and a molecular weight of 346.43 g/mol. Its IUPAC name is N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide
PubChem CID39839792
Molecular FormulaC16H14N2O3S2
Molecular Weight346.43 g/mol
Exact Mass346.04
IUPAC NameN-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(OCc2ccccn2)c1)c1cccs1
InChIInChI=1S/C16H14N2O3S2/c19-23(20,16-8-4-10-22-16)18-13-6-3-7-15(11-13)21-12-14-5-1-2-9-17-14/h1-11,18H,12H2
InChIKeyZSEQAKUGOIISLR-UHFFFAOYSA-N
XLogP3.52
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.43
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methylsulfonyl-N-[3-(pyridin-2-ylmethoxy)phenyl]benzenesulfonamide
CID 55645155
3,4-dimethoxy-N-[3-(pyridin-2-ylmethoxy)phenyl]benzenesulfonamide
CID 43069653
2,3-dichloro-N-[3-(pyridin-2-ylmethoxy)phenyl]benzenesulfonamide
CID 43069625
4-[[3-(pyridin-2-ylmethoxy)phenyl]sulfamoyl]benzoic acid
CID 55645126
N-[3-(pyridin-2-ylmethoxy)phenyl]-4-(trifluoromethoxy)benzenesulfonamide
CID 43069660
(E)-2-phenyl-N-[3-(pyridin-2-ylmethoxy)phenyl]ethenesulfonamide
CID 43069636
2-chloro-N-[3-(pyridin-2-ylmethoxy)phenyl]-5-(trifluoromethyl)benzenesulfonamide
CID 43069632
N-[3-[2-(1,2,4-triazol-1-yl)ethoxy]phenyl]thiophene-2-sulfonamide
CID 55820522
N-[6-(3-methoxyanilino)-3-pyridinyl]thiophene-2-sulfonamide
CID 113019463
3-[(4-fluorophenyl)sulfamoyl]-N-[3-(pyridin-2-ylmethoxy)phenyl]benzamide
CID 38669447
4-methyl-N-[3-(2-pyridin-2-ylethoxy)phenyl]benzenesulfonamide
CID 169372850
N-(2-pyridin-2-ylethyl)-3-(thiophen-2-ylsulfonylamino)naphthalene-2-carboxamide
CID 24628570

Frequently Asked Questions

What is the IUPAC name of N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide?
The IUPAC name of N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide (CID 39839792) is N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide is O=S(=O)(Nc1cccc(OCc2ccccn2)c1)c1cccs1.
What is the InChIKey of N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide?
The InChIKey is ZSEQAKUGOIISLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O3S2/c19-23(20,16-8-4-10-22-16)18-13-6-3-7-15(11-13)21-12-14-5-1-2-9-17-14/h1-11,18H,12H2.
What are the key properties of N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide?
N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide has a molecular weight of 346.43 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(pyridin-2-ylmethoxy)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 39839792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).