N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide

C12H13FN4O2S — CID 103299543

IUPACN-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide
SMILESCN(C)c1ccc(NS(=O)(=O)c2ncccc2F)cn1
InChIInChI=1S/C12H13FN4O2S/c1-17(2)11-6-5-9(8-15-11)16-20(18,19)12-10(13)4-3-7-14-12/h3-8,16H,1-2H3
InChIKeyQTSNILLWODDPQN-UHFFFAOYSA-N
MW296.33 g/mol
LogP1.48
Rot. Bonds4

About N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide

N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide (PubChem CID 103299543) has the molecular formula C12H13FN4O2S and a molecular weight of 296.33 g/mol. Its IUPAC name is N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide
PubChem CID103299543
Molecular FormulaC12H13FN4O2S
Molecular Weight296.33 g/mol
Exact Mass296.07
IUPAC NameN-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide
SMILESCN(C)c1ccc(NS(=O)(=O)c2ncccc2F)cn1
InChIInChI=1S/C12H13FN4O2S/c1-17(2)11-6-5-9(8-15-11)16-20(18,19)12-10(13)4-3-7-14-12/h3-8,16H,1-2H3
InChIKeyQTSNILLWODDPQN-UHFFFAOYSA-N
XLogP1.48
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.33
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-fluoro-N',N'-dimethylpyridine-2-sulfonohydrazide
CID 103300356
N-(3,4-dichlorophenyl)-3-fluoropyridine-2-sulfonamide
CID 103299127
4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzenecarbothioamide
CID 103300634
N-[4-(1-aminoethyl)phenyl]-3-fluoropyridine-2-sulfonamide
CID 103298978
4-bromo-N-[6-(dimethylamino)-3-pyridinyl]-3-fluorobenzenesulfonamide
CID 103709775
3-fluoro-N-naphthalen-2-ylpyridine-2-sulfonamide
CID 103299396
4-[(3-fluoro-2-pyridinyl)sulfonylamino]benzamide
CID 103299122
5-chloro-N-[6-(dimethylamino)-3-pyridinyl]-1-methylimidazole-4-sulfonamide
CID 61051800
3-fluoro-N-(2-fluorophenyl)pyridine-2-sulfonamide
CID 103299037
2-chloro-N-[6-(dimethylamino)-3-pyridinyl]pyridine-4-sulfonamide
CID 61051988
N-[4-(2-aminoethoxy)phenyl]-3-fluoropyridine-2-sulfonamide
CID 103298449
N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide
CID 103308189

Frequently Asked Questions

What is the IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide (CID 103299543) is N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide is CN(C)c1ccc(NS(=O)(=O)c2ncccc2F)cn1.
What is the InChIKey of N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide?
The InChIKey is QTSNILLWODDPQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13FN4O2S/c1-17(2)11-6-5-9(8-15-11)16-20(18,19)12-10(13)4-3-7-14-12/h3-8,16H,1-2H3.
What are the key properties of N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide?
N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide has a molecular weight of 296.33 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(dimethylamino)-3-pyridinyl]-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103299543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).