3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide

C11H17ClN4O3S — CID 62180159

IUPAC3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)NCCCS(N)(=O)=O)n1
InChIInChI=1S/C11H17ClN4O3S/c1-2-14-9-5-4-8(12)10(16-9)11(17)15-6-3-7-20(13,18)19/h4-5H,2-3,6-7H2,1H3,(H,14,16)(H,15,17)(H2,13,18,19)
InChIKeyVOOUNAYROGEPCC-UHFFFAOYSA-N
MW320.80 g/mol
LogP0.58
Rot. Bonds7

About 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide

3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide (PubChem CID 62180159) has the molecular formula C11H17ClN4O3S and a molecular weight of 320.80 g/mol. Its IUPAC name is 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide
PubChem CID62180159
Molecular FormulaC11H17ClN4O3S
Molecular Weight320.80 g/mol
Exact Mass320.07
IUPAC Name3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)NCCCS(N)(=O)=O)n1
InChIInChI=1S/C11H17ClN4O3S/c1-2-14-9-5-4-8(12)10(16-9)11(17)15-6-3-7-20(13,18)19/h4-5H,2-3,6-7H2,1H3,(H,14,16)(H,15,17)(H2,13,18,19)
InChIKeyVOOUNAYROGEPCC-UHFFFAOYSA-N
XLogP0.58
TPSA114.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.80
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-chloro-6-(ethylamino)-N-[2-(trifluoromethylsulfanyl)ethyl]pyridine-2-carboxamide
CID 106432994
3-chloro-6-(ethylamino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62170609
3-chloro-N-(2-cyclopentylethyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62181281
3-chloro-N-(3-ethoxypropyl)-6-(propylamino)pyridine-2-carboxamide
CID 62165038
3-chloro-6-(ethylamino)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]pyridine-2-carboxamide
CID 106050133
3-chloro-6-(ethylamino)-N-[2-(5-methyl-1,2,4-oxadiazol-3-yl)ethyl]pyridine-2-carboxamide
CID 106422842
2-chloro-5-hydroxy-N-(3-sulfamoylpropyl)benzamide
CID 106501692
4-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-3-carboxamide
CID 81242250
5-chloro-2-(propylamino)-N-(3-sulfamoylpropyl)pyridine-4-carboxamide
CID 114922642
3-chloro-6-(ethylamino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 62165390
3-chloro-6-hydrazinyl-N-[4-[methyl(propan-2-yl)amino]butyl]pyridine-2-carboxamide
CID 62248018
3-chloro-6-(ethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 62165294

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide (CID 62180159) is 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide is CCNc1ccc(Cl)c(C(=O)NCCCS(N)(=O)=O)n1.
What is the InChIKey of 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide?
The InChIKey is VOOUNAYROGEPCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN4O3S/c1-2-14-9-5-4-8(12)10(16-9)11(17)15-6-3-7-20(13,18)19/h4-5H,2-3,6-7H2,1H3,(H,14,16)(H,15,17)(H2,13,18,19).
What are the key properties of 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide?
3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide has a molecular weight of 320.80 g/mol, XLogP of 0.58, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(ethylamino)-N-(3-sulfamoylpropyl)pyridine-2-carboxamide is sourced from PubChem (CID 62180159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).