[2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate

C19H21N3O7S — CID 2352062

IUPAC[2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate
SMILESCOc1cc(S(=O)(=O)N2CCOCC2)ccc1NC(=O)COC(=O)c1ccccn1
InChIInChI=1S/C19H21N3O7S/c1-27-17-12-14(30(25,26)22-8-10-28-11-9-22)5-6-15(17)21-18(23)13-29-19(24)16-4-2-3-7-20-16/h2-7,12H,8-11,13H2,1H3,(H,21,23)
InChIKeyBOCWYOWWHSNLPQ-UHFFFAOYSA-N
MW435.46 g/mol
LogP0.91
Rot. Bonds7

About [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate

[2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate (PubChem CID 2352062) has the molecular formula C19H21N3O7S and a molecular weight of 435.46 g/mol. Its IUPAC name is [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate.

Molecular Properties

Compound Name[2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate
PubChem CID2352062
Molecular FormulaC19H21N3O7S
Molecular Weight435.46 g/mol
Exact Mass435.11
IUPAC Name[2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate
SMILESCOc1cc(S(=O)(=O)N2CCOCC2)ccc1NC(=O)COC(=O)c1ccccn1
InChIInChI=1S/C19H21N3O7S/c1-27-17-12-14(30(25,26)22-8-10-28-11-9-22)5-6-15(17)21-18(23)13-29-19(24)16-4-2-3-7-20-16/h2-7,12H,8-11,13H2,1H3,(H,21,23)
InChIKeyBOCWYOWWHSNLPQ-UHFFFAOYSA-N
XLogP0.91
TPSA124.13 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.46
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate 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-Methoxy-3-piperidin-1-ylsulfonylanilino)-2-oxoethyl] 1-methylpyrrole-2-carboxylate
CID 4253900
N-{2-methoxy-4-[(2-methylphenyl)sulfamoyl]phenyl}pyridine-4-carboxamide
CID 1076108
N-(2-Methoxy-4-p-tolylsulfamoyl-phenyl)-isonicotinamide
CID 1078654
N-{4-[(2-methoxyphenyl)sulfamoyl]phenyl}pyridine-4-carboxamide
CID 1078659
N-[4-[(4-ethoxyphenyl)sulfamoyl]-2-methoxyphenyl]pyridine-3-carboxamide
CID 2354347
N-[4-(diethylamino)-3-[(2-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
CID 3360888
4-Methoxy-benzenesulfonic acid 2-[(pyridine-2-carbonyl)-amino]-phenyl ester
CID 44291010
N-(3-methoxy-4-(N-(2-methoxyphenyl)sulfamoyl)phenyl)picolinamide
CID 49865401
Pyridine-2-carboxylic acid (2-methoxy-phenylcarbamoyl)-methyl ester
CID 1088747
N-[4-[(2-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
CID 2545056
N-[4-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
CID 2546677
N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]pyridine-2-carboxamide
CID 4225129

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate?
The IUPAC name of [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate (CID 2352062) is [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate.
What is the SMILES notation for [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate?
The canonical SMILES for [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate is COc1cc(S(=O)(=O)N2CCOCC2)ccc1NC(=O)COC(=O)c1ccccn1.
What is the InChIKey of [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate?
The InChIKey is BOCWYOWWHSNLPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O7S/c1-27-17-12-14(30(25,26)22-8-10-28-11-9-22)5-6-15(17)21-18(23)13-29-19(24)16-4-2-3-7-20-16/h2-7,12H,8-11,13H2,1H3,(H,21,23).
What are the key properties of [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate?
[2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate has a molecular weight of 435.46 g/mol, XLogP of 0.91, 7 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] pyridine-2-carboxylate is sourced from PubChem (CID 2352062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).