N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide

C14H17N3O2S — CID 62144380

IUPACN-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide
SMILESCCc1cccc(NS(=O)(=O)c2cccnc2NC)c1
InChIInChI=1S/C14H17N3O2S/c1-3-11-6-4-7-12(10-11)17-20(18,19)13-8-5-9-16-14(13)15-2/h4-10,17H,3H2,1-2H3,(H,15,16)
InChIKeyXDLRLKURPLAFTM-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.49
Rot. Bonds5

About N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide

N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide (PubChem CID 62144380) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide
PubChem CID62144380
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC NameN-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide
SMILESCCc1cccc(NS(=O)(=O)c2cccnc2NC)c1
InChIInChI=1S/C14H17N3O2S/c1-3-11-6-4-7-12(10-11)17-20(18,19)13-8-5-9-16-14(13)15-2/h4-10,17H,3H2,1-2H3,(H,15,16)
InChIKeyXDLRLKURPLAFTM-UHFFFAOYSA-N
XLogP2.49
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(3-ethylphenyl)pyridine-3-sulfonamide
CID 24621325
N-(3-ethylphenyl)pyridine-2-sulfonamide
CID 67565790
N-[(4-ethylphenyl)methyl]-2-(methylamino)pyridine-3-sulfonamide
CID 106900712
N-(2-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62144368
N-(4-bromo-3-methylphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62149915
N-(3-methylphenyl)-2-(propylamino)pyridine-3-sulfonamide
CID 62149101
N-(3-ethylphenyl)-1-propylpyrrolo[2,3-b]pyridine-3-sulfonamide
CID 53174101
2-(methylamino)-N-[(3-methylphenyl)methyl]pyridine-3-sulfonamide
CID 62146869
N-(3-chloro-4-methoxyphenyl)-2-(methylamino)pyridine-3-sulfonamide
CID 62164737
2-(methylamino)-N-(1,2-oxazol-4-yl)pyridine-3-sulfonamide
CID 55130880
N-(3-ethylphenyl)-1-(2-methylpropyl)pyrrolo[2,3-b]pyridine-3-sulfonamide
CID 53174152
5-bromo-N-(3-ethylphenyl)-2-hydrazinylpyridine-3-sulfonamide
CID 61298536

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide?
The IUPAC name of N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide (CID 62144380) is N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide.
What is the SMILES notation for N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide?
The canonical SMILES for N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide is CCc1cccc(NS(=O)(=O)c2cccnc2NC)c1.
What is the InChIKey of N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide?
The InChIKey is XDLRLKURPLAFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-3-11-6-4-7-12(10-11)17-20(18,19)13-8-5-9-16-14(13)15-2/h4-10,17H,3H2,1-2H3,(H,15,16).
What are the key properties of N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide?
N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide has a molecular weight of 291.38 g/mol, XLogP of 2.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylphenyl)-2-(methylamino)pyridine-3-sulfonamide is sourced from PubChem (CID 62144380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).