5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide

C10H10ClN5O2S — CID 64607730

IUPAC5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide
SMILESCNc1ncc(S(=O)(=O)Nc2ncccn2)cc1Cl
InChIInChI=1S/C10H10ClN5O2S/c1-12-9-8(11)5-7(6-15-9)19(17,18)16-10-13-3-2-4-14-10/h2-6H,1H3,(H,12,15)(H,13,14,16)
InChIKeyLSSHNRXNXYRMMG-UHFFFAOYSA-N
MW299.74 g/mol
LogP1.37
Rot. Bonds4

About 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide

5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide (PubChem CID 64607730) has the molecular formula C10H10ClN5O2S and a molecular weight of 299.74 g/mol. Its IUPAC name is 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide
PubChem CID64607730
Molecular FormulaC10H10ClN5O2S
Molecular Weight299.74 g/mol
Exact Mass299.02
IUPAC Name5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide
SMILESCNc1ncc(S(=O)(=O)Nc2ncccn2)cc1Cl
InChIInChI=1S/C10H10ClN5O2S/c1-12-9-8(11)5-7(6-15-9)19(17,18)16-10-13-3-2-4-14-10/h2-6H,1H3,(H,12,15)(H,13,14,16)
InChIKeyLSSHNRXNXYRMMG-UHFFFAOYSA-N
XLogP1.37
TPSA96.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.74
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-chloro-6-hydrazinyl-N-pyrimidin-2-ylpyridine-3-sulfonamide
CID 64608544
5-chloro-N-(2,5-dichlorophenyl)-6-(methylamino)pyridine-3-sulfonamide
CID 64606214
5-chloro-N-(3-chloro-2-fluorophenyl)-6-(methylamino)pyridine-3-sulfonamide
CID 64608883
5-chloro-N-(2,3-dimethylphenyl)-6-(methylamino)pyridine-3-sulfonamide
CID 64608516
N-(5-bromo-2-chlorophenyl)-5-chloro-6-(methylamino)pyridine-3-sulfonamide
CID 64601121
5-chloro-6-(methylamino)-N-(2-methylbutan-2-yl)pyridine-3-sulfonamide
CID 64607176
N-(2-bromo-6-fluorophenyl)-5-chloro-6-(methylamino)pyridine-3-sulfonamide
CID 107603183
5-chloro-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-(methylamino)pyridine-3-sulfonamide
CID 64602862
5-chloro-6-(methylamino)-N-(3,3,3-trifluoropropyl)pyridine-3-sulfonamide
CID 64602290
5-chloro-N-hexyl-6-(methylamino)pyridine-3-sulfonamide
CID 64602106
5-chloro-6-hydrazinyl-N-(1,2,4-triazin-3-yl)pyridine-3-sulfonamide
CID 114388272
5-chloro-N-(3-ethyl-1-methylpyrazol-4-yl)-6-(methylamino)pyridine-3-sulfonamide
CID 107464615

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide (CID 64607730) is 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide is CNc1ncc(S(=O)(=O)Nc2ncccn2)cc1Cl.
What is the InChIKey of 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide?
The InChIKey is LSSHNRXNXYRMMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN5O2S/c1-12-9-8(11)5-7(6-15-9)19(17,18)16-10-13-3-2-4-14-10/h2-6H,1H3,(H,12,15)(H,13,14,16).
What are the key properties of 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide?
5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide has a molecular weight of 299.74 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(methylamino)-N-pyrimidin-2-ylpyridine-3-sulfonamide is sourced from PubChem (CID 64607730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).