N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide

C20H24N2O4S — CID 7602988

IUPACN-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide
SMILESCOc1ccc(C)cc1NC(=O)CCNS(=O)(=O)/C=C/c1ccc(C)cc1
InChIInChI=1S/C20H24N2O4S/c1-15-4-7-17(8-5-15)11-13-27(24,25)21-12-10-20(23)22-18-14-16(2)6-9-19(18)26-3/h4-9,11,13-14,21H,10,12H2,1-3H3,(H,22,23)/b13-11+
InChIKeyQGPROZYRCQIDNL-ACCUITESSA-N
MW388.49 g/mol
LogP3.23
Rot. Bonds8

About N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide

N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide (PubChem CID 7602988) has the molecular formula C20H24N2O4S and a molecular weight of 388.49 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide
PubChem CID7602988
Molecular FormulaC20H24N2O4S
Molecular Weight388.49 g/mol
Exact Mass388.15
IUPAC NameN-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide
SMILESCOc1ccc(C)cc1NC(=O)CCNS(=O)(=O)/C=C/c1ccc(C)cc1
InChIInChI=1S/C20H24N2O4S/c1-15-4-7-17(8-5-15)11-13-27(24,25)21-12-10-20(23)22-18-14-16(2)6-9-19(18)26-3/h4-9,11,13-14,21H,10,12H2,1-3H3,(H,22,23)/b13-11+
InChIKeyQGPROZYRCQIDNL-ACCUITESSA-N
XLogP3.23
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.49
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide
CID 9270924
[2-(2-methoxy-5-methylanilino)-2-oxoethyl] 2-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]acetate
CID 18276091
N,N'-bis(2-methoxy-5-methylphenyl)pentanediamide
CID 5142107
N-(2-methoxy-5-methylphenyl)-3-(4-methylanilino)propanamide
CID 109034471
[2-(2-methoxy-5-methylanilino)-2-oxoethyl] (E)-3-(4-methylphenyl)prop-2-enoate
CID 42967097
N-(2-methoxy-5-methylphenyl)-4-oxopentanamide
CID 60636995
N-(2-methoxy-5-methylphenyl)-2-(propylsulfonylamino)acetamide
CID 112998937
N-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]-2-methylpropanamide
CID 50875904
N-(2-methoxy-5-methylphenyl)dodecanamide
CID 4196048
3-(butylamino)-N-(2-methoxy-5-methylphenyl)propanamide
CID 109012484
[2-oxo-2-(propan-2-ylamino)ethyl] 3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanoate
CID 9066476
N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide
CID 51159592

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide (CID 7602988) is N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide is COc1ccc(C)cc1NC(=O)CCNS(=O)(=O)/C=C/c1ccc(C)cc1.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide?
The InChIKey is QGPROZYRCQIDNL-ACCUITESSA-N. The full InChI is InChI=1S/C20H24N2O4S/c1-15-4-7-17(8-5-15)11-13-27(24,25)21-12-10-20(23)22-18-14-16(2)6-9-19(18)26-3/h4-9,11,13-14,21H,10,12H2,1-3H3,(H,22,23)/b13-11+.
What are the key properties of N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide?
N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide has a molecular weight of 388.49 g/mol, XLogP of 3.23, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-3-[[(E)-2-(4-methylphenyl)ethenyl]sulfonylamino]propanamide is sourced from PubChem (CID 7602988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).