2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide

C12H10N4O2S2 — CID 106595764

IUPAC2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide
SMILESN#Cc1ncccc1S(=O)(=O)Nc1nc2c(s1)CCC2
InChIInChI=1S/C12H10N4O2S2/c13-7-9-11(5-2-6-14-9)20(17,18)16-12-15-8-3-1-4-10(8)19-12/h2,5-6H,1,3-4H2,(H,15,16)
InChIKeyHCVMECYYSLJQOQ-UHFFFAOYSA-N
MW306.37 g/mol
LogP1.70
Rot. Bonds3

About 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide

2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide (PubChem CID 106595764) has the molecular formula C12H10N4O2S2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide
PubChem CID106595764
Molecular FormulaC12H10N4O2S2
Molecular Weight306.37 g/mol
Exact Mass306.02
IUPAC Name2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide
SMILESN#Cc1ncccc1S(=O)(=O)Nc1nc2c(s1)CCC2
InChIInChI=1S/C12H10N4O2S2/c13-7-9-11(5-2-6-14-9)20(17,18)16-12-15-8-3-1-4-10(8)19-12/h2,5-6H,1,3-4H2,(H,15,16)
InChIKeyHCVMECYYSLJQOQ-UHFFFAOYSA-N
XLogP1.70
TPSA95.74 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-amino-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-2-sulfonamide
CID 103305510
2-cyano-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyridine-3-sulfonamide
CID 106596248
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-(ethylamino)benzenesulfonamide
CID 62152211
4-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3-methylbenzenesulfonamide
CID 106919755
2-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-ylamino)pyridine-3-carbonitrile
CID 54963648
2,5-dichloro-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)benzenesulfonamide
CID 3566516
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-3,4-dimethylbenzenesulfonamide
CID 84569915
N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62152569
5-(aminomethyl)-2-bromo-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)furan-3-sulfonamide
CID 106053348
2-cyano-N-(2,6-dimethylphenyl)pyridine-3-sulfonamide
CID 106595467
5-bromo-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiophene-2-sulfonamide
CID 3323683
N-[5-(3-aminoprop-1-ynyl)-1,3-thiazol-2-yl]-2-cyanopyridine-3-sulfonamide
CID 106598860

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide?
The IUPAC name of 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide (CID 106595764) is 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide?
The canonical SMILES for 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide is N#Cc1ncccc1S(=O)(=O)Nc1nc2c(s1)CCC2.
What is the InChIKey of 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide?
The InChIKey is HCVMECYYSLJQOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O2S2/c13-7-9-11(5-2-6-14-9)20(17,18)16-12-15-8-3-1-4-10(8)19-12/h2,5-6H,1,3-4H2,(H,15,16).
What are the key properties of 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide?
2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide has a molecular weight of 306.37 g/mol, XLogP of 1.70, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-(5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 106595764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).