5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide

C11H14ClN5O2S — CID 64607000

IUPAC5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)Nc2cnn(C)c2)cc1Cl
InChIInChI=1S/C11H14ClN5O2S/c1-3-13-11-10(12)4-9(6-14-11)20(18,19)16-8-5-15-17(2)7-8/h4-7,16H,3H2,1-2H3,(H,13,14)
InChIKeyYPSPXBNDERZRNR-UHFFFAOYSA-N
MW315.79 g/mol
LogP1.70
Rot. Bonds5

About 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide

5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide (PubChem CID 64607000) has the molecular formula C11H14ClN5O2S and a molecular weight of 315.79 g/mol. Its IUPAC name is 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide
PubChem CID64607000
Molecular FormulaC11H14ClN5O2S
Molecular Weight315.79 g/mol
Exact Mass315.06
IUPAC Name5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide
SMILESCCNc1ncc(S(=O)(=O)Nc2cnn(C)c2)cc1Cl
InChIInChI=1S/C11H14ClN5O2S/c1-3-13-11-10(12)4-9(6-14-11)20(18,19)16-8-5-15-17(2)7-8/h4-7,16H,3H2,1-2H3,(H,13,14)
InChIKeyYPSPXBNDERZRNR-UHFFFAOYSA-N
XLogP1.70
TPSA88.91 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.79
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-(ethylamino)-N-(1-methylpyrazol-4-yl)pyrimidine-5-sulfonamide
CID 62146781
5-chloro-6-(ethylamino)pyridine-3-sulfonamide
CID 64608699
4-amino-3-chloro-N-(1-methylpyrazol-4-yl)benzenesulfonamide
CID 115329714
5-chloro-6-(ethylamino)-N-(1-methylcyclohexyl)pyridine-3-sulfonamide
CID 64602451
5-chloro-6-(ethylamino)-N-pyridin-2-ylpyridine-3-sulfonamide
CID 64607180
3-chloro-4-cyano-N-(1-methylpyrazol-4-yl)benzenesulfonamide
CID 47309988
4-(ethylamino)-2,6-dimethyl-N-(1-methylpyrazol-4-yl)benzenesulfonamide
CID 107328677
5-chloro-6-(ethylamino)-N-pentan-3-ylpyridine-3-sulfonamide
CID 64608495
5-chloro-6-(ethylamino)-N-(thiatriazol-5-yl)pyridine-3-sulfonamide
CID 114914138
5-chloro-N-(3,5-dimethyl-1H-pyrazol-4-yl)-6-(ethylamino)pyridine-3-sulfonamide
CID 64600101
5-chloro-6-(ethylamino)-N-(2-methylcyclopentyl)pyridine-3-sulfonamide
CID 64600545
4-amino-2,6-dichloro-N-(1-methylpyrazol-4-yl)benzenesulfonamide
CID 43534674

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide (CID 64607000) is 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide is CCNc1ncc(S(=O)(=O)Nc2cnn(C)c2)cc1Cl.
What is the InChIKey of 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide?
The InChIKey is YPSPXBNDERZRNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN5O2S/c1-3-13-11-10(12)4-9(6-14-11)20(18,19)16-8-5-15-17(2)7-8/h4-7,16H,3H2,1-2H3,(H,13,14).
What are the key properties of 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide?
5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide has a molecular weight of 315.79 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-(ethylamino)-N-(1-methylpyrazol-4-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 64607000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).