6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide

C10H11ClN4O2S2 — CID 64600162

IUPAC6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide
SMILESNc1ncc(S(=O)(=O)NCCc2cscn2)cc1Cl
InChIInChI=1S/C10H11ClN4O2S2/c11-9-3-8(4-13-10(9)12)19(16,17)15-2-1-7-5-18-6-14-7/h3-6,15H,1-2H2,(H2,12,13)
InChIKeyINSALOPMJGLQMY-UHFFFAOYSA-N
MW318.81 g/mol
LogP1.29
Rot. Bonds5

About 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide

6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide (PubChem CID 64600162) has the molecular formula C10H11ClN4O2S2 and a molecular weight of 318.81 g/mol. Its IUPAC name is 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide
PubChem CID64600162
Molecular FormulaC10H11ClN4O2S2
Molecular Weight318.81 g/mol
Exact Mass318.00
IUPAC Name6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide
SMILESNc1ncc(S(=O)(=O)NCCc2cscn2)cc1Cl
InChIInChI=1S/C10H11ClN4O2S2/c11-9-3-8(4-13-10(9)12)19(16,17)15-2-1-7-5-18-6-14-7/h3-6,15H,1-2H2,(H2,12,13)
InChIKeyINSALOPMJGLQMY-UHFFFAOYSA-N
XLogP1.29
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.81
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-amino-5-chloro-N-(2-pyridin-2-ylethyl)pyridine-3-sulfonamide
CID 64607542
2-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyrimidine-5-sulfonamide
CID 63823602
4-amino-2-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]benzenesulfonamide
CID 55261418
3-amino-4,5-dimethyl-N-[2-(1,3-thiazol-4-yl)ethyl]benzenesulfonamide
CID 63829315
6-hydrazinyl-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide
CID 63826100
6-amino-5-chloro-N-[2-(4-fluorophenyl)ethyl]pyridine-3-sulfonamide
CID 64606219
3-amino-5-fluoro-N-[2-(1,3-thiazol-4-yl)ethyl]benzenesulfonamide
CID 63829852
6-amino-5-chloro-N-(2-methylpropyl)pyridine-3-sulfonamide
CID 64607743
6-amino-5-chloro-N-(3-methylsulfonylpropyl)pyridine-3-sulfonamide
CID 64602641
4-fluoro-N-[2-(1,3-thiazol-4-yl)ethyl]benzenesulfonamide
CID 63824991
3-ethyl-N-[2-(1,3-thiazol-4-yl)ethyl]-[1,2]oxazolo[5,4-b]pyridine-5-sulfonamide
CID 75522790
4-amino-3-chloro-N-(1,3-thiazol-4-ylmethyl)benzenesulfonamide
CID 113288438

Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide?
The IUPAC name of 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide (CID 64600162) is 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide is Nc1ncc(S(=O)(=O)NCCc2cscn2)cc1Cl.
What is the InChIKey of 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide?
The InChIKey is INSALOPMJGLQMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O2S2/c11-9-3-8(4-13-10(9)12)19(16,17)15-2-1-7-5-18-6-14-7/h3-6,15H,1-2H2,(H2,12,13).
What are the key properties of 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide?
6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide has a molecular weight of 318.81 g/mol, XLogP of 1.29, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-[2-(1,3-thiazol-4-yl)ethyl]pyridine-3-sulfonamide is sourced from PubChem (CID 64600162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).