N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide

C16H11F3N2O2S — CID 167877527

IUPACN-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1ncccc1C(F)(F)F)c1ccc2ccccc2c1
InChIInChI=1S/C16H11F3N2O2S/c17-16(18,19)14-6-3-9-20-15(14)21-24(22,23)13-8-7-11-4-1-2-5-12(11)10-13/h1-10H,(H,20,21)
InChIKeyWONOSVXAZBRSRG-UHFFFAOYSA-N
MW352.34 g/mol
LogP4.05
Rot. Bonds3

About N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide

N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide (PubChem CID 167877527) has the molecular formula C16H11F3N2O2S and a molecular weight of 352.34 g/mol. Its IUPAC name is N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide
PubChem CID167877527
Molecular FormulaC16H11F3N2O2S
Molecular Weight352.34 g/mol
Exact Mass352.05
IUPAC NameN-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1ncccc1C(F)(F)F)c1ccc2ccccc2c1
InChIInChI=1S/C16H11F3N2O2S/c17-16(18,19)14-6-3-9-20-15(14)21-24(22,23)13-8-7-11-4-1-2-5-12(11)10-13/h1-10H,(H,20,21)
InChIKeyWONOSVXAZBRSRG-UHFFFAOYSA-N
XLogP4.05
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.34
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-1-sulfonamide
CID 167863794
N-pyridin-3-ylnaphthalene-2-sulfonamide
CID 849014
N-[3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-2-pyridinyl]thiophene-2-sulfonamide
CID 57382886
4-chloro-N-pyrimidin-2-yl-3-(trifluoromethyl)benzenesulfonamide
CID 75505555
N-[3-[3-(naphthalen-2-ylsulfonylamino)pyrazin-2-yl]phenyl]acetamide
CID 126474142
N-isoquinolin-1-yl-3,5-bis(trifluoromethyl)benzenesulfonamide
CID 74228494
2-(naphthalen-2-ylsulfonylamino)-N-(1-oxo-3-phenylpropan-2-yl)pyridine-3-carboxamide
CID 22988100
N-(2,2,2-trifluoroethoxy)naphthalene-2-sulfonamide
CID 82715252
N-[5-(naphthalen-2-ylsulfonylamino)naphthalen-1-yl]naphthalene-2-sulfonamide
CID 3407912
4-[(4-methoxyphenyl)sulfamoyl]-N-[2-[[3-(trifluoromethyl)-2-pyridinyl]amino]ethyl]benzamide
CID 55834263
3-fluoro-N-naphthalen-2-ylpyridine-2-sulfonamide
CID 103299396
quinolin-8-yl 2-(naphthalen-2-ylsulfonylamino)benzoate
CID 3301854

Frequently Asked Questions

What is the IUPAC name of N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide?
The IUPAC name of N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide (CID 167877527) is N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide?
The canonical SMILES for N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide is O=S(=O)(Nc1ncccc1C(F)(F)F)c1ccc2ccccc2c1.
What is the InChIKey of N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide?
The InChIKey is WONOSVXAZBRSRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F3N2O2S/c17-16(18,19)14-6-3-9-20-15(14)21-24(22,23)13-8-7-11-4-1-2-5-12(11)10-13/h1-10H,(H,20,21).
What are the key properties of N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide?
N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide has a molecular weight of 352.34 g/mol, XLogP of 4.05, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(trifluoromethyl)-2-pyridinyl]naphthalene-2-sulfonamide is sourced from PubChem (CID 167877527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).