4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide

C19H22N2O4S — CID 26520994

IUPAC4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide
SMILESCc1ccc(C(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2C)cc1
InChIInChI=1S/C19H22N2O4S/c1-14-3-6-16(7-4-14)19(22)20-18-13-17(8-5-15(18)2)26(23,24)21-9-11-25-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22)
InChIKeyQJWYGHYLUCKFKP-UHFFFAOYSA-N
MW374.46 g/mol
LogP2.58
Rot. Bonds4

About 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide

4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide (PubChem CID 26520994) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide.

Molecular Properties

Compound Name4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide
PubChem CID26520994
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC Name4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide
SMILESCc1ccc(C(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2C)cc1
InChIInChI=1S/C19H22N2O4S/c1-14-3-6-16(7-4-14)19(22)20-18-13-17(8-5-15(18)2)26(23,24)21-9-11-25-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22)
InChIKeyQJWYGHYLUCKFKP-UHFFFAOYSA-N
XLogP2.58
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-dimethylphenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
CID 2596699
methyl 4-methyl-3-[(2-methyl-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoate
CID 26198226
N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-4-methylsulfonylbenzamide
CID 18284846
N-(3,5-dimethylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1077896
4-methyl-N-[4-[2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]ethylcarbamoyl]phenyl]benzamide
CID 121062034
2,6-dimethyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)quinoline-3-carboxamide
CID 55466253
N-(5-fluoro-2-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide
CID 3653486
N-(2-hydroxy-5-pyrrolidin-1-ylsulfonylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 27672653
methyl 3-[(2-chloro-5-morpholin-4-ylsulfonylbenzoyl)amino]-4-methylbenzoate
CID 26198212
3-benzamido-4-methyl-N-[(4-morpholin-4-ylsulfonylphenyl)methyl]benzamide
CID 55635484
N-(2,5-dimethylphenyl)-5-morpholin-4-ylsulfonyl-2-piperidin-1-ylbenzamide
CID 26909307
methyl 4-[(2-methyl-5-piperidin-1-ylsulfonylphenyl)carbamoyl]benzoate
CID 7695652

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide?
The IUPAC name of 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide (CID 26520994) is 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide.
What is the SMILES notation for 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide?
The canonical SMILES for 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide is Cc1ccc(C(=O)Nc2cc(S(=O)(=O)N3CCOCC3)ccc2C)cc1.
What is the InChIKey of 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide?
The InChIKey is QJWYGHYLUCKFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-14-3-6-16(7-4-14)19(22)20-18-13-17(8-5-15(18)2)26(23,24)21-9-11-25-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22).
What are the key properties of 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide?
4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide has a molecular weight of 374.46 g/mol, XLogP of 2.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide is sourced from PubChem (CID 26520994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).