(E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide

C17H18N2O5S — CID 24634483

IUPAC(E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide
SMILESCOc1cccc(/C=C/C(=O)Nc2ccc(OC)c(S(N)(=O)=O)c2)c1
InChIInChI=1S/C17H18N2O5S/c1-23-14-5-3-4-12(10-14)6-9-17(20)19-13-7-8-15(24-2)16(11-13)25(18,21)22/h3-11H,1-2H3,(H,19,20)(H2,18,21,22)/b9-6+
InChIKeyOXGKLTGSROKMBC-RMKNXTFCSA-N
MW362.41 g/mol
LogP2.00
Rot. Bonds6

About (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide

(E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide (PubChem CID 24634483) has the molecular formula C17H18N2O5S and a molecular weight of 362.41 g/mol. Its IUPAC name is (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide
PubChem CID24634483
Molecular FormulaC17H18N2O5S
Molecular Weight362.41 g/mol
Exact Mass362.09
IUPAC Name(E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide
SMILESCOc1cccc(/C=C/C(=O)Nc2ccc(OC)c(S(N)(=O)=O)c2)c1
InChIInChI=1S/C17H18N2O5S/c1-23-14-5-3-4-12(10-14)6-9-17(20)19-13-7-8-15(24-2)16(11-13)25(18,21)22/h3-11H,1-2H3,(H,19,20)(H2,18,21,22)/b9-6+
InChIKeyOXGKLTGSROKMBC-RMKNXTFCSA-N
XLogP2.00
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.41
LogP ≤ 52.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)prop-2-enamide
CID 75460082
N-(4-methoxy-3-sulfamoylphenyl)-3-(4-propan-2-ylphenyl)prop-2-enamide
CID 78611118
(E)-3-(3-methoxyphenyl)-N-[3-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl]prop-2-enamide
CID 135359675
(E)-3-(3-chlorophenyl)-N-(4-methyl-3-sulfamoylphenyl)prop-2-enamide
CID 9140915
(E)-N-[3-(dimethylsulfamoyl)-4-methoxyphenyl]-3-(3-fluorophenyl)prop-2-enamide
CID 9106601
(E)-3-(2,3-dimethoxyphenyl)-N-(4-methyl-3-sulfamoylphenyl)prop-2-enamide
CID 9140940
N-(3-chlorophenyl)-3-(3-methoxy-4-sulfamoylphenyl)prop-2-enamide
CID 67338697
(E)-3-(6-methoxynaphthalen-2-yl)-N-(3-sulfamoylphenyl)prop-2-enamide
CID 34752671
(E)-N-(3-acetamidophenyl)-3-(3,5-dimethoxyphenyl)prop-2-enamide
CID 26688768
(E)-3-(3-methoxyphenyl)-N-[4-(trifluoromethyl)phenyl]prop-2-enamide
CID 2684281
3-[5-(4-bromophenyl)thiophen-2-yl]-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide
CID 74625119
(E)-3-(3-methoxyphenyl)-N-[(2-methylpropan-2-yl)oxy]prop-2-enamide
CID 82723936

Frequently Asked Questions

What is the IUPAC name of (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide?
The IUPAC name of (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide (CID 24634483) is (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide.
What is the SMILES notation for (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide?
The canonical SMILES for (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide is COc1cccc(/C=C/C(=O)Nc2ccc(OC)c(S(N)(=O)=O)c2)c1.
What is the InChIKey of (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide?
The InChIKey is OXGKLTGSROKMBC-RMKNXTFCSA-N. The full InChI is InChI=1S/C17H18N2O5S/c1-23-14-5-3-4-12(10-14)6-9-17(20)19-13-7-8-15(24-2)16(11-13)25(18,21)22/h3-11H,1-2H3,(H,19,20)(H2,18,21,22)/b9-6+.
What are the key properties of (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide?
(E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide has a molecular weight of 362.41 g/mol, XLogP of 2.00, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-(3-methoxyphenyl)-N-(4-methoxy-3-sulfamoylphenyl)prop-2-enamide is sourced from PubChem (CID 24634483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).