N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide

C11H7F3N2O3S2 — CID 75521559

IUPACN-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide
SMILESO=C(NS(=O)(=O)c1cccs1)c1ncccc1C(F)(F)F
InChIInChI=1S/C11H7F3N2O3S2/c12-11(13,14)7-3-1-5-15-9(7)10(17)16-21(18,19)8-4-2-6-20-8/h1-6H,(H,16,17)
InChIKeyFQHYXDBESFYBHU-UHFFFAOYSA-N
MW336.32 g/mol
LogP2.28
Rot. Bonds3

About N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide

N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide (PubChem CID 75521559) has the molecular formula C11H7F3N2O3S2 and a molecular weight of 336.32 g/mol. Its IUPAC name is N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide
PubChem CID75521559
Molecular FormulaC11H7F3N2O3S2
Molecular Weight336.32 g/mol
Exact Mass335.99
IUPAC NameN-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide
SMILESO=C(NS(=O)(=O)c1cccs1)c1ncccc1C(F)(F)F
InChIInChI=1S/C11H7F3N2O3S2/c12-11(13,14)7-3-1-5-15-9(7)10(17)16-21(18,19)8-4-2-6-20-8/h1-6H,(H,16,17)
InChIKeyFQHYXDBESFYBHU-UHFFFAOYSA-N
XLogP2.28
TPSA76.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.32
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

thiophen-2-ylsulfonylurea;urea
CID 19065180
2-chloro-N-thiophen-2-ylsulfonylbenzamide
CID 975839
N-methoxymethanamine;3-(trifluoromethyl)pyridine-2-carboxylic acid
CID 171925814
N-[2-[[3-(trifluoromethyl)-2-pyridinyl]amino]ethyl]thiophene-2-carboxamide
CID 131963289
N-[3-[[4-chloro-3-(trifluoromethyl)phenyl]sulfonylamino]-2-pyridinyl]thiophene-2-sulfonamide
CID 57382886
N-[3,4-bis(trifluoromethyl)phenyl]thiophene-2-sulfonamide
CID 2474123
N-thiophen-2-ylsulfonylprop-2-enamide
CID 139972027
2-thiophen-2-yl-N-[2-[[3-(trifluoromethyl)-2-pyridinyl]amino]ethyl]acetamide
CID 51090526
pyridin-3-yl-[3-(trifluoromethyl)-2-pyridinyl]methanone
CID 139764799
methyl 2-[[3-(trifluoromethyl)pyridine-2-carbonyl]amino]cycloheptane-1-carboxylate
CID 75440536
N-fluorothiophene-2-sulfonamide
CID 175398216
N-[(thiophen-2-ylsulfonylamino)methyl]pyridine-2-carboxamide
CID 140674283

Frequently Asked Questions

What is the IUPAC name of N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide?
The IUPAC name of N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide (CID 75521559) is N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide.
What is the SMILES notation for N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide?
The canonical SMILES for N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide is O=C(NS(=O)(=O)c1cccs1)c1ncccc1C(F)(F)F.
What is the InChIKey of N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide?
The InChIKey is FQHYXDBESFYBHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F3N2O3S2/c12-11(13,14)7-3-1-5-15-9(7)10(17)16-21(18,19)8-4-2-6-20-8/h1-6H,(H,16,17).
What are the key properties of N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide?
N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide has a molecular weight of 336.32 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-thiophen-2-ylsulfonyl-3-(trifluoromethyl)pyridine-2-carboxamide is sourced from PubChem (CID 75521559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).