5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide

C10H10BrClN4O2S — CID 60779710

IUPAC5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide
SMILESCCn1cc(NS(=O)(=O)c2cc(Br)cnc2Cl)cn1
InChIInChI=1S/C10H10BrClN4O2S/c1-2-16-6-8(5-14-16)15-19(17,18)9-3-7(11)4-13-10(9)12/h3-6,15H,2H2,1H3
InChIKeyHJJAHNOODYZQBN-UHFFFAOYSA-N
MW365.64 g/mol
LogP2.51
Rot. Bonds4

About 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide

5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide (PubChem CID 60779710) has the molecular formula C10H10BrClN4O2S and a molecular weight of 365.64 g/mol. Its IUPAC name is 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide
PubChem CID60779710
Molecular FormulaC10H10BrClN4O2S
Molecular Weight365.64 g/mol
Exact Mass363.94
IUPAC Name5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide
SMILESCCn1cc(NS(=O)(=O)c2cc(Br)cnc2Cl)cn1
InChIInChI=1S/C10H10BrClN4O2S/c1-2-16-6-8(5-14-16)15-19(17,18)9-3-7(11)4-13-10(9)12/h3-6,15H,2H2,1H3
InChIKeyHJJAHNOODYZQBN-UHFFFAOYSA-N
XLogP2.51
TPSA76.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.64
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-amino-4-bromo-N-(1-ethylpyrazol-4-yl)benzenesulfonamide
CID 43543211
5-chloro-N-(1-ethylpyrazol-4-yl)-2-methylbenzenesulfonamide
CID 39836974
5-bromo-N-(4-bromo-3,5-dimethylphenyl)-2-chloropyridine-3-sulfonamide
CID 107573390
2-amino-5-bromo-N-(1-ethylpyrazol-4-yl)-4-fluorobenzenesulfonamide
CID 106491419
2-amino-5-bromo-N-[1-(2-methoxyethyl)pyrazol-4-yl]pyridine-3-sulfonamide
CID 62153432
5-bromo-2-chloro-N-(3,5-dichloro-4-fluorophenyl)pyridine-3-sulfonamide
CID 107573401
6-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide
CID 39836918
5-bromo-2-chloro-N-methylpyridine-3-sulfonamide
CID 61059658
5-amino-4-bromo-N-(1-ethylpyrazol-4-yl)-2-methoxybenzenesulfonamide
CID 81396831
5-bromo-2-chloro-N-(2,4,6-trimethylphenyl)pyridine-3-sulfonamide
CID 61300253
5-bromo-2-chloro-N-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-sulfonamide
CID 61298899
5-bromo-2-chloro-N-(2-methylbutyl)pyridine-3-sulfonamide
CID 62693299

Frequently Asked Questions

What is the IUPAC name of 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide (CID 60779710) is 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide is CCn1cc(NS(=O)(=O)c2cc(Br)cnc2Cl)cn1.
What is the InChIKey of 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide?
The InChIKey is HJJAHNOODYZQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrClN4O2S/c1-2-16-6-8(5-14-16)15-19(17,18)9-3-7(11)4-13-10(9)12/h3-6,15H,2H2,1H3.
What are the key properties of 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide?
5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide has a molecular weight of 365.64 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-2-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 60779710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).