2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide

C24H25N3O4S — CID 24529088

IUPAC2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide
SMILESCc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)c1ccc(-c2ccccc2)nc1C
InChIInChI=1S/C24H25N3O4S/c1-17-8-9-20(32(29,30)27-12-14-31-15-13-27)16-23(17)26-24(28)21-10-11-22(25-18(21)2)19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3,(H,26,28)
InChIKeyYKGFZCURXRMMHI-UHFFFAOYSA-N
MW451.55 g/mol
LogP3.64
Rot. Bonds5

About 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide

2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide (PubChem CID 24529088) has the molecular formula C24H25N3O4S and a molecular weight of 451.55 g/mol. Its IUPAC name is 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide
PubChem CID24529088
Molecular FormulaC24H25N3O4S
Molecular Weight451.55 g/mol
Exact Mass451.16
IUPAC Name2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide
SMILESCc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)c1ccc(-c2ccccc2)nc1C
InChIInChI=1S/C24H25N3O4S/c1-17-8-9-20(32(29,30)27-12-14-31-15-13-27)16-23(17)26-24(28)21-10-11-22(25-18(21)2)19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3,(H,26,28)
InChIKeyYKGFZCURXRMMHI-UHFFFAOYSA-N
XLogP3.64
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.55
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,6-dimethyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)quinoline-3-carboxamide
CID 55466253
ethyl 2-methyl-6-[(2-methyl-5-morpholin-4-ylsulfonylphenyl)carbamoyl]pyridine-3-carboxylate
CID 55600474
2-methyl-6-phenyl-N-(3-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 27006276
N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepine-1-carboxamide
CID 55602264
2-methyl-5-morpholin-4-ylsulfonyl-N-(4-phenylphenyl)benzamide
CID 2676901
4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide
CID 26520994
N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 55329582
2-(2-cyanophenyl)-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide
CID 55380831
N-(2-chloro-5-morpholin-4-ylsulfonylphenyl)-2-(4-methylphenyl)quinoline-4-carboxamide
CID 4638958
N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzamide
CID 55432805
2-methyl-6-phenyl-N-(2-piperidin-1-ylsulfonylphenyl)pyridine-3-carboxamide
CID 52662748
N-(2-acetylphenyl)-2-methyl-5-morpholin-4-ylsulfonylbenzamide
CID 8749628

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide?
The IUPAC name of 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide (CID 24529088) is 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide.
What is the SMILES notation for 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide?
The canonical SMILES for 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide is Cc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)c1ccc(-c2ccccc2)nc1C.
What is the InChIKey of 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide?
The InChIKey is YKGFZCURXRMMHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O4S/c1-17-8-9-20(32(29,30)27-12-14-31-15-13-27)16-23(17)26-24(28)21-10-11-22(25-18(21)2)19-6-4-3-5-7-19/h3-11,16H,12-15H2,1-2H3,(H,26,28).
What are the key properties of 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide?
2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide has a molecular weight of 451.55 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)-6-phenylpyridine-3-carboxamide is sourced from PubChem (CID 24529088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).