N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide

C10H11BrN4O2S2 — CID 62147032

IUPACN-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2ncc(Br)s2)cn1
InChIInChI=1S/C10H11BrN4O2S2/c1-2-12-9-4-3-7(5-13-9)19(16,17)15-10-14-6-8(11)18-10/h3-6H,2H2,1H3,(H,12,13)(H,14,15)
InChIKeyKWALYIFDOJGMRP-UHFFFAOYSA-N
MW363.26 g/mol
LogP2.53
Rot. Bonds5

About N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide

N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide (PubChem CID 62147032) has the molecular formula C10H11BrN4O2S2 and a molecular weight of 363.26 g/mol. Its IUPAC name is N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide
PubChem CID62147032
Molecular FormulaC10H11BrN4O2S2
Molecular Weight363.26 g/mol
Exact Mass361.95
IUPAC NameN-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)Nc2ncc(Br)s2)cn1
InChIInChI=1S/C10H11BrN4O2S2/c1-2-12-9-4-3-7(5-13-9)19(16,17)15-10-14-6-8(11)18-10/h3-6H,2H2,1H3,(H,12,13)(H,14,15)
InChIKeyKWALYIFDOJGMRP-UHFFFAOYSA-N
XLogP2.53
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.26
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(ethylamino)-N-methylpyridine-3-sulfonamide
CID 62150384
N-[2-(5-bromothiophen-2-yl)ethyl]-6-(ethylamino)pyridine-3-sulfonamide
CID 106049801
N-(5-bromo-1,3-thiazol-2-yl)-4-hydroxybenzenesulfonamide
CID 60785748
N-(2-bromo-4-methylphenyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62164228
6-(ethylamino)-N-(4-fluorophenyl)pyridine-3-sulfonamide
CID 62145209
N-(5-bromo-1,3-thiazol-2-yl)-4-[(propan-2-ylamino)methyl]benzenesulfonamide
CID 60823723
N-(3-bromo-4-fluorophenyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 104781528
6-(ethylamino)-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 62143880
N-[(4-bromophenyl)methyl]-6-(ethylamino)pyridine-3-sulfonamide
CID 62150157
6-(ethylamino)-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
CID 114389293
6-(ethylamino)-N-pyridazin-3-ylpyridine-3-sulfonamide
CID 116787805
6-(ethylamino)-N-(2-methyl-3-pyridinyl)pyridine-3-sulfonamide
CID 79043938

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide?
The IUPAC name of N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide (CID 62147032) is N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide is CCNc1ccc(S(=O)(=O)Nc2ncc(Br)s2)cn1.
What is the InChIKey of N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide?
The InChIKey is KWALYIFDOJGMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11BrN4O2S2/c1-2-12-9-4-3-7(5-13-9)19(16,17)15-10-14-6-8(11)18-10/h3-6H,2H2,1H3,(H,12,13)(H,14,15).
What are the key properties of N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide?
N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide has a molecular weight of 363.26 g/mol, XLogP of 2.53, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-1,3-thiazol-2-yl)-6-(ethylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62147032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).