N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide

C15H19N3O2S — CID 62148688

IUPACN-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)Nc2cc(C)ccc2C)ccn1
InChIInChI=1S/C15H19N3O2S/c1-4-16-15-10-13(7-8-17-15)21(19,20)18-14-9-11(2)5-6-12(14)3/h5-10,18H,4H2,1-3H3,(H,16,17)
InChIKeyNQULPPWVGDOCEM-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.93
Rot. Bonds5

About N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide

N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide (PubChem CID 62148688) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
PubChem CID62148688
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC NameN-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
SMILESCCNc1cc(S(=O)(=O)Nc2cc(C)ccc2C)ccn1
InChIInChI=1S/C15H19N3O2S/c1-4-16-15-10-13(7-8-17-15)21(19,20)18-14-9-11(2)5-6-12(14)3/h5-10,18H,4H2,1-3H3,(H,16,17)
InChIKeyNQULPPWVGDOCEM-UHFFFAOYSA-N
XLogP2.93
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-bromo-4-methylphenyl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62164386
N-(2,5-dimethylphenyl)-2-hydrazinylpyridine-4-sulfonamide
CID 61004704
2-(ethylamino)-N-(3-fluoro-4-methylphenyl)pyridine-4-sulfonamide
CID 62143671
2-(ethylamino)-N-propan-2-ylpyridine-4-sulfonamide
CID 62149834
N-(5-bromo-2-chlorophenyl)-2-(ethylamino)pyridine-4-sulfonamide
CID 62908445
2-(ethylamino)-N-(3-ethylpentan-3-yl)pyridine-4-sulfonamide
CID 65042331
2-(ethylamino)-N-(1,3,4-thiadiazol-2-yl)pyridine-4-sulfonamide
CID 62162458
N-(2-fluoro-5-methylphenyl)-2-(methylamino)pyridine-4-sulfonamide
CID 62143380
N-(3,4-dimethyl-1,2-oxazol-5-yl)-2-(ethylamino)pyridine-4-sulfonamide
CID 65481175
N,N-diethyl-2-(ethylamino)pyridine-4-sulfonamide
CID 62150008
N-(2,5-dimethylphenyl)-3-methylbenzenesulfonamide
CID 47104321
N-(2-bromo-4-methylphenyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 62164228

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide?
The IUPAC name of N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide (CID 62148688) is N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide is CCNc1cc(S(=O)(=O)Nc2cc(C)ccc2C)ccn1.
What is the InChIKey of N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide?
The InChIKey is NQULPPWVGDOCEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-4-16-15-10-13(7-8-17-15)21(19,20)18-14-9-11(2)5-6-12(14)3/h5-10,18H,4H2,1-3H3,(H,16,17).
What are the key properties of N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide?
N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide has a molecular weight of 305.40 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-2-(ethylamino)pyridine-4-sulfonamide is sourced from PubChem (CID 62148688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).