2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide

C11H10N4O2S2 — CID 106545998

IUPAC2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide
SMILESCC(NS(=O)(=O)c1cccnc1C#N)c1nccs1
InChIInChI=1S/C11H10N4O2S2/c1-8(11-14-5-6-18-11)15-19(16,17)10-3-2-4-13-9(10)7-12/h2-6,8,15H,1H3
InChIKeyAXILAUXSFWLQNF-UHFFFAOYSA-N
MW294.36 g/mol
LogP1.45
Rot. Bonds4

About 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide

2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide (PubChem CID 106545998) has the molecular formula C11H10N4O2S2 and a molecular weight of 294.36 g/mol. Its IUPAC name is 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide
PubChem CID106545998
Molecular FormulaC11H10N4O2S2
Molecular Weight294.36 g/mol
Exact Mass294.02
IUPAC Name2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide
SMILESCC(NS(=O)(=O)c1cccnc1C#N)c1nccs1
InChIInChI=1S/C11H10N4O2S2/c1-8(11-14-5-6-18-11)15-19(16,17)10-3-2-4-13-9(10)7-12/h2-6,8,15H,1H3
InChIKeyAXILAUXSFWLQNF-UHFFFAOYSA-N
XLogP1.45
TPSA95.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-cyano-N-[1-(5-methylthiophen-2-yl)ethyl]pyridine-3-sulfonamide
CID 106545698
2-chloro-5-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]benzenesulfonamide
CID 80704573
6-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide
CID 115616292
N-tert-butyl-2-[(2-cyano-3-pyridinyl)sulfonylamino]propanamide
CID 106545736
3-[(2-cyano-3-pyridinyl)sulfonylamino]butanoic acid
CID 106593255
2-cyano-N-(1-methoxypropan-2-yl)pyridine-3-sulfonamide
CID 106545154
2-cyano-N-(4-methoxybutan-2-yl)pyridine-3-sulfonamide
CID 106545893
2-cyano-N-(4-methylsulfanylbutan-2-yl)pyridine-3-sulfonamide
CID 106546133
3-chloro-4-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]benzenesulfonamide
CID 115616293
2-cyano-N-(4-methylsulfinylbutan-2-yl)pyridine-3-sulfonamide
CID 106596242
tert-butyl (2R)-2-[(2-cyano-3-pyridinyl)sulfonylamino]propanoate
CID 106546546
2-cyano-N-(2,2,3-trimethylbutyl)pyridine-3-sulfonamide
CID 106546835

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide?
The IUPAC name of 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide (CID 106545998) is 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide is CC(NS(=O)(=O)c1cccnc1C#N)c1nccs1.
What is the InChIKey of 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide?
The InChIKey is AXILAUXSFWLQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O2S2/c1-8(11-14-5-6-18-11)15-19(16,17)10-3-2-4-13-9(10)7-12/h2-6,8,15H,1H3.
What are the key properties of 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide?
2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide has a molecular weight of 294.36 g/mol, XLogP of 1.45, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-[1-(1,3-thiazol-2-yl)ethyl]pyridine-3-sulfonamide is sourced from PubChem (CID 106545998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).