2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide

C23H25N3O6S — CID 53120284

IUPAC2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cccnc1Oc1ccc(NS(=O)(=O)c2cc(OC)ccc2OC)cc1
InChIInChI=1S/C23H25N3O6S/c1-4-13-24-22(27)19-6-5-14-25-23(19)32-17-9-7-16(8-10-17)26-33(28,29)21-15-18(30-2)11-12-20(21)31-3/h5-12,14-15,26H,4,13H2,1-3H3,(H,24,27)
InChIKeyYXHMEKLREBHKLO-UHFFFAOYSA-N
MW471.54 g/mol
LogP3.83
Rot. Bonds10

About 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide

2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide (PubChem CID 53120284) has the molecular formula C23H25N3O6S and a molecular weight of 471.54 g/mol. Its IUPAC name is 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide
PubChem CID53120284
Molecular FormulaC23H25N3O6S
Molecular Weight471.54 g/mol
Exact Mass471.15
IUPAC Name2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide
SMILESCCCNC(=O)c1cccnc1Oc1ccc(NS(=O)(=O)c2cc(OC)ccc2OC)cc1
InChIInChI=1S/C23H25N3O6S/c1-4-13-24-22(27)19-6-5-14-25-23(19)32-17-9-7-16(8-10-17)26-33(28,29)21-15-18(30-2)11-12-20(21)31-3/h5-12,14-15,26H,4,13H2,1-3H3,(H,24,27)
InChIKeyYXHMEKLREBHKLO-UHFFFAOYSA-N
XLogP3.83
TPSA115.85 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.54
LogP ≤ 53.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-[4-[(5-chlorothiophen-2-yl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide
CID 53120306
N-cyclobutyl-2-[3-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]pyridine-3-carboxamide
CID 53117671
2-[3-[(2,5-dimethylphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide
CID 53117682
N-ethyl-2-[4-(methanesulfonamido)phenoxy]pyridine-3-carboxamide
CID 53120244
2,5-dimethoxy-N-(2-methoxy-3-pyridinyl)benzenesulfonamide
CID 47038313
N-pentyl-2-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)phenoxy]pyridine-3-carboxamide
CID 53120314
2,5-dimethoxy-N-pyrimidin-2-ylbenzenesulfonamide
CID 19683567
N-[2-(diethylamino)ethyl]-4-[(2,5-dimethoxyphenyl)sulfonylamino]benzamide
CID 3585915
N-[(2S)-butan-2-yl]-2-[4-[(2,4-dimethylphenyl)sulfonylamino]phenoxy]pyridine-3-carboxamide
CID 95089271
2-[4-(methanesulfonamido)phenoxy]-N-prop-2-enylpyridine-3-carboxamide
CID 53120247
2-[4-[(4-cyclohexylphenyl)sulfonylamino]phenoxy]-N-ethylpyridine-3-carboxamide
CID 53120274
2-[3-(methanesulfonamido)phenoxy]-N-pentylpyridine-3-carboxamide
CID 53117639

Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide?
The IUPAC name of 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide (CID 53120284) is 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide.
What is the SMILES notation for 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide?
The canonical SMILES for 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide is CCCNC(=O)c1cccnc1Oc1ccc(NS(=O)(=O)c2cc(OC)ccc2OC)cc1.
What is the InChIKey of 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide?
The InChIKey is YXHMEKLREBHKLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O6S/c1-4-13-24-22(27)19-6-5-14-25-23(19)32-17-9-7-16(8-10-17)26-33(28,29)21-15-18(30-2)11-12-20(21)31-3/h5-12,14-15,26H,4,13H2,1-3H3,(H,24,27).
What are the key properties of 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide?
2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide has a molecular weight of 471.54 g/mol, XLogP of 3.83, 10 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 53120284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).