N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide

C23H24N2O4S — CID 41448889

IUPACN-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(CCNC(=O)c2cccc(NS(=O)(=O)c3ccc(C)cc3)c2)cc1
InChIInChI=1S/C23H24N2O4S/c1-17-6-12-22(13-7-17)30(27,28)25-20-5-3-4-19(16-20)23(26)24-15-14-18-8-10-21(29-2)11-9-18/h3-13,16,25H,14-15H2,1-2H3,(H,24,26)
InChIKeyUWVCDDSDGMVAOM-UHFFFAOYSA-N
MW424.52 g/mol
LogP3.78
Rot. Bonds8

About N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide

N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide (PubChem CID 41448889) has the molecular formula C23H24N2O4S and a molecular weight of 424.52 g/mol. Its IUPAC name is N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide
PubChem CID41448889
Molecular FormulaC23H24N2O4S
Molecular Weight424.52 g/mol
Exact Mass424.15
IUPAC NameN-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide
SMILESCOc1ccc(CCNC(=O)c2cccc(NS(=O)(=O)c3ccc(C)cc3)c2)cc1
InChIInChI=1S/C23H24N2O4S/c1-17-6-12-22(13-7-17)30(27,28)25-20-5-3-4-19(16-20)23(26)24-15-14-18-8-10-21(29-2)11-9-18/h3-13,16,25H,14-15H2,1-2H3,(H,24,26)
InChIKeyUWVCDDSDGMVAOM-UHFFFAOYSA-N
XLogP3.78
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.52
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-3-[(3-methylphenyl)sulfamoyl]benzamide
CID 27548654
N-[2-(4-methoxyphenoxy)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 24504263
3-[(4-methoxyphenyl)sulfamoyl]-N-(2-phenylethyl)benzamide
CID 18108709
N-benzyl-3-[(4-methoxyphenyl)sulfonylamino]benzamide
CID 7542047
3-(benzenesulfonamido)-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide
CID 38502452
3-[(4-methoxyphenyl)sulfonylamino]-N-[4-[4-[[3-[(4-methoxyphenyl)sulfonylamino]benzoyl]amino]phenyl]phenyl]benzamide
CID 121043305
N-[2-(4-methoxyphenyl)ethyl]-4-[(2-methylphenyl)sulfamoyl]benzamide
CID 27548689
N-(2,5-dimethoxyphenyl)-3-[(4-methylphenyl)sulfonylamino]benzamide
CID 41455271
3-(carbamoylamino)-N-[2-(4-methylphenyl)ethyl]benzamide
CID 134691241
3-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 670722
3-methyl-N-[2-[4-[(3-methylbenzoyl)sulfamoyl]phenyl]ethyl]benzamide
CID 3438717
N-[2-(4-methoxyphenyl)ethyl]-3-(pyridin-4-ylamino)benzamide
CID 117092507

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide?
The IUPAC name of N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide (CID 41448889) is N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide.
What is the SMILES notation for N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide?
The canonical SMILES for N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide is COc1ccc(CCNC(=O)c2cccc(NS(=O)(=O)c3ccc(C)cc3)c2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide?
The InChIKey is UWVCDDSDGMVAOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4S/c1-17-6-12-22(13-7-17)30(27,28)25-20-5-3-4-19(16-20)23(26)24-15-14-18-8-10-21(29-2)11-9-18/h3-13,16,25H,14-15H2,1-2H3,(H,24,26).
What are the key properties of N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide?
N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide has a molecular weight of 424.52 g/mol, XLogP of 3.78, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenyl)ethyl]-3-[(4-methylphenyl)sulfonylamino]benzamide is sourced from PubChem (CID 41448889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).