N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide

C19H22N2O5S — CID 6461849

IUPACN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)c1ccccc1C
InChIInChI=1S/C19H22N2O5S/c1-14-5-3-4-6-16(14)19(22)20-17-13-15(7-8-18(17)25-2)27(23,24)21-9-11-26-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22)
InChIKeyPRZFTCQMFMFYSA-UHFFFAOYSA-N
MW390.46 g/mol
LogP2.28
Rot. Bonds5

About N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide

N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide (PubChem CID 6461849) has the molecular formula C19H22N2O5S and a molecular weight of 390.46 g/mol. Its IUPAC name is N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide
PubChem CID6461849
Molecular FormulaC19H22N2O5S
Molecular Weight390.46 g/mol
Exact Mass390.12
IUPAC NameN-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)c1ccccc1C
InChIInChI=1S/C19H22N2O5S/c1-14-5-3-4-6-16(14)19(22)20-17-13-15(7-8-18(17)25-2)27(23,24)21-9-11-26-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22)
InChIKeyPRZFTCQMFMFYSA-UHFFFAOYSA-N
XLogP2.28
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide?
The IUPAC name of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide (CID 6461849) is N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide.
What is the SMILES notation for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide?
The canonical SMILES for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide is COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)c1ccccc1C.
What is the InChIKey of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide?
The InChIKey is PRZFTCQMFMFYSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O5S/c1-14-5-3-4-6-16(14)19(22)20-17-13-15(7-8-18(17)25-2)27(23,24)21-9-11-26-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22).
What are the key properties of N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide?
N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide has a molecular weight of 390.46 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-2-methylbenzamide is sourced from PubChem (CID 6461849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).