4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide

C20H24N2O4S — CID 7958233

IUPAC4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C20H24N2O4S/c1-15(2)18-5-3-4-6-19(18)21-20(23)16-7-9-17(10-8-16)27(24,25)22-11-13-26-14-12-22/h3-10,15H,11-14H2,1-2H3,(H,21,23)
InChIKeyYLVXHMBOIRXQMG-UHFFFAOYSA-N
MW388.49 g/mol
LogP3.08
Rot. Bonds5

About 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide

4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide (PubChem CID 7958233) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide.

Molecular Properties

Compound Name4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide
PubChem CID7958233
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC Name4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide
SMILESCC(C)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C20H24N2O4S/c1-15(2)18-5-3-4-6-19(18)21-20(23)16-7-9-17(10-8-16)27(24,25)22-11-13-26-14-12-22/h3-10,15H,11-14H2,1-2H3,(H,21,23)
InChIKeyYLVXHMBOIRXQMG-UHFFFAOYSA-N
XLogP3.08
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethoxyphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 650265
N-[(2R)-butan-2-yl]-2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]benzamide
CID 26706280
N-(2-ethylsulfonylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 55613517
4-[[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methyl]-N-(2-propan-2-ylphenyl)benzamide
CID 43923946
N-tert-butyl-2-[(4-morpholin-4-ylsulfonylbenzoyl)amino]benzamide
CID 100679235
N-[(1R)-1-(2-chlorophenyl)ethyl]-4-morpholin-4-ylsulfonylbenzamide
CID 8700706
4-morpholin-4-ylsulfonyl-N-[2-(2,2,2-trifluoroethylsulfanyl)phenyl]benzamide
CID 16609512
N-(2-methyl-6-propan-2-ylphenyl)-4-pyrrolidin-1-ylsulfonylbenzamide
CID 2701412
N-(4-acetylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 1152899
4-iodo-N-(4-morpholin-4-ylsulfonylphenyl)benzamide
CID 3955565
4-morpholin-4-ylsulfonyl-N-quinolin-8-ylbenzamide
CID 26123616
4-morpholin-4-ylsulfonyl-N-(2-phenoxy-3-pyridinyl)benzamide
CID 43068510

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide?
The IUPAC name of 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide (CID 7958233) is 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide.
What is the SMILES notation for 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide?
The canonical SMILES for 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide is CC(C)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide?
The InChIKey is YLVXHMBOIRXQMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-15(2)18-5-3-4-6-19(18)21-20(23)16-7-9-17(10-8-16)27(24,25)22-11-13-26-14-12-22/h3-10,15H,11-14H2,1-2H3,(H,21,23).
What are the key properties of 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide?
4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide has a molecular weight of 388.49 g/mol, XLogP of 3.08, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylsulfonyl-N-(2-propan-2-ylphenyl)benzamide is sourced from PubChem (CID 7958233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).