5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide

C23H32N2O5S — CID 33161310

IUPAC5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NCCc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C23H32N2O5S/c1-6-25(7-2)31(27,28)20-12-13-22(29-5)21(16-20)23(26)24-15-14-18-8-10-19(11-9-18)30-17(3)4/h8-13,16-17H,6-7,14-15H2,1-5H3,(H,24,26)
InChIKeyPHHTUUONIIOZCR-UHFFFAOYSA-N
MW448.59 g/mol
LogP3.49
Rot. Bonds11

About 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide

5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide (PubChem CID 33161310) has the molecular formula C23H32N2O5S and a molecular weight of 448.59 g/mol. Its IUPAC name is 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide.

Molecular Properties

Compound Name5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide
PubChem CID33161310
Molecular FormulaC23H32N2O5S
Molecular Weight448.59 g/mol
Exact Mass448.20
IUPAC Name5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide
SMILESCCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NCCc2ccc(OC(C)C)cc2)c1
InChIInChI=1S/C23H32N2O5S/c1-6-25(7-2)31(27,28)20-12-13-22(29-5)21(16-20)23(26)24-15-14-18-8-10-19(11-9-18)30-17(3)4/h8-13,16-17H,6-7,14-15H2,1-5H3,(H,24,26)
InChIKeyPHHTUUONIIOZCR-UHFFFAOYSA-N
XLogP3.49
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500448.59
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(diethylsulfamoyl)-2-methoxy-N-(2-thiophen-2-ylethyl)benzamide
CID 19257817
methyl 5-[[[5-(diethylsulfamoyl)-2-methoxybenzoyl]amino]methyl]-2-methoxybenzoate
CID 55650630
2,5-dimethoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 18189798
5-(diethylsulfamoyl)-2-methoxy-N-phenylbenzamide
CID 19257737
2-chloro-5-(diethylsulfamoyl)-N-(2-phenylethyl)benzamide
CID 7732727
5-(diethylsulfamoyl)-2-methyl-N-[2-(4-nitrophenyl)ethyl]benzamide
CID 60566565
5-(ethylsulfamoyl)-2-methoxy-N-(2-phenylethyl)benzamide
CID 19257913
5-(diethylsulfamoyl)-2-methoxy-N-(3-propan-2-ylphenyl)benzamide
CID 38707307
5-(diethylsulfamoyl)-N-[4-(dimethylsulfamoyl)phenyl]-2-methoxybenzamide
CID 19257781
N-[2-[4-(diethylsulfamoyl)phenyl]ethyl]-N'-[(4-methoxyphenyl)methyl]oxamide
CID 30126544
5-chloro-2-methoxy-N-[2-(4-methylsulfonylphenyl)ethyl]benzamide
CID 170994520
4-propan-2-yloxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 4794711

Frequently Asked Questions

What is the IUPAC name of 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide?
The IUPAC name of 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide (CID 33161310) is 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide.
What is the SMILES notation for 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide?
The canonical SMILES for 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide is CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NCCc2ccc(OC(C)C)cc2)c1.
What is the InChIKey of 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide?
The InChIKey is PHHTUUONIIOZCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32N2O5S/c1-6-25(7-2)31(27,28)20-12-13-22(29-5)21(16-20)23(26)24-15-14-18-8-10-19(11-9-18)30-17(3)4/h8-13,16-17H,6-7,14-15H2,1-5H3,(H,24,26).
What are the key properties of 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide?
5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide has a molecular weight of 448.59 g/mol, XLogP of 3.49, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(diethylsulfamoyl)-2-methoxy-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide is sourced from PubChem (CID 33161310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).