2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide

C21H19N3O4S — CID 53120215

IUPAC2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cccnc1Oc1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C21H19N3O4S/c25-20(23-15-8-9-15)19-7-4-14-22-21(19)28-17-12-10-16(11-13-17)24-29(26,27)18-5-2-1-3-6-18/h1-7,10-15,24H,8-9H2,(H,23,25)
InChIKeyRMNGPQOVLSIAHK-UHFFFAOYSA-N
MW409.47 g/mol
LogP3.57
Rot. Bonds7

About 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide

2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide (PubChem CID 53120215) has the molecular formula C21H19N3O4S and a molecular weight of 409.47 g/mol. Its IUPAC name is 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide
PubChem CID53120215
Molecular FormulaC21H19N3O4S
Molecular Weight409.47 g/mol
Exact Mass409.11
IUPAC Name2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cccnc1Oc1ccc(NS(=O)(=O)c2ccccc2)cc1
InChIInChI=1S/C21H19N3O4S/c25-20(23-15-8-9-15)19-7-4-14-22-21(19)28-17-12-10-16(11-13-17)24-29(26,27)18-5-2-1-3-6-18/h1-7,10-15,24H,8-9H2,(H,23,25)
InChIKeyRMNGPQOVLSIAHK-UHFFFAOYSA-N
XLogP3.57
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.47
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-[(4-acetamidophenyl)sulfonylamino]phenoxy]-N-cyclopentylpyridine-3-carboxamide
CID 53120219
N-cyclopentyl-2-[3-[(4-fluorophenyl)sulfonylamino]phenoxy]pyridine-3-carboxamide
CID 53117616
2-[3-[(4-cyclohexylphenyl)sulfonylamino]phenoxy]-N-cyclopropylpyridine-3-carboxamide
CID 53117717
6-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide
CID 53119974
N-cyclopropyl-2-[3-[[4-(2-methylpropyl)phenyl]sulfonylamino]phenoxy]pyridine-3-carboxamide
CID 53117722
4-[[2-(4-fluorophenoxy)pyridine-3-carbonyl]amino]cyclohexane-1-carboxylic acid
CID 22058409
2-[4-[(4-cyclohexylphenyl)sulfonylamino]phenoxy]-N-ethylpyridine-3-carboxamide
CID 53120274
2-[4-[(4-bromophenyl)sulfonylamino]phenoxy]-N-propan-2-ylpyridine-3-carboxamide
CID 53120166
2-[[4-(benzenesulfonamido)benzoyl]amino]-N-cyclopropylbenzamide
CID 34281161
N-cyclobutyl-2-[3-[(3,4-dimethoxyphenyl)sulfonylamino]phenoxy]pyridine-3-carboxamide
CID 53117672
N-cyclobutyl-2-[3-[(2,5-dimethoxyphenyl)sulfonylamino]phenoxy]pyridine-3-carboxamide
CID 53117671
4-(benzenesulfonamido)-N-cyclooctylbenzamide
CID 24635133

Frequently Asked Questions

What is the IUPAC name of 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide?
The IUPAC name of 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide (CID 53120215) is 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide.
What is the SMILES notation for 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide?
The canonical SMILES for 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide is O=C(NC1CC1)c1cccnc1Oc1ccc(NS(=O)(=O)c2ccccc2)cc1.
What is the InChIKey of 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide?
The InChIKey is RMNGPQOVLSIAHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N3O4S/c25-20(23-15-8-9-15)19-7-4-14-22-21(19)28-17-12-10-16(11-13-17)24-29(26,27)18-5-2-1-3-6-18/h1-7,10-15,24H,8-9H2,(H,23,25).
What are the key properties of 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide?
2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide has a molecular weight of 409.47 g/mol, XLogP of 3.57, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(benzenesulfonamido)phenoxy]-N-cyclopropylpyridine-3-carboxamide is sourced from PubChem (CID 53120215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).