N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide

C12H18N2O5S — CID 65375421

IUPACN-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide
SMILESCCN(C)C(=O)c1cc(S(N)(=O)=O)c(OC)cc1OC
InChIInChI=1S/C12H18N2O5S/c1-5-14(2)12(15)8-6-11(20(13,16)17)10(19-4)7-9(8)18-3/h6-7H,5H2,1-4H3,(H2,13,16,17)
InChIKeyQEJMXCMBROVUMF-UHFFFAOYSA-N
MW302.35 g/mol
LogP0.44
Rot. Bonds5

About N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide

N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide (PubChem CID 65375421) has the molecular formula C12H18N2O5S and a molecular weight of 302.35 g/mol. Its IUPAC name is N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide
PubChem CID65375421
Molecular FormulaC12H18N2O5S
Molecular Weight302.35 g/mol
Exact Mass302.09
IUPAC NameN-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide
SMILESCCN(C)C(=O)c1cc(S(N)(=O)=O)c(OC)cc1OC
InChIInChI=1S/C12H18N2O5S/c1-5-14(2)12(15)8-6-11(20(13,16)17)10(19-4)7-9(8)18-3/h6-7H,5H2,1-4H3,(H2,13,16,17)
InChIKeyQEJMXCMBROVUMF-UHFFFAOYSA-N
XLogP0.44
TPSA98.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide
CID 65373113
methyl 2,4-dimethoxy-5-sulfamoylbenzoate
CID 63840880
N-ethyl-2,4-difluoro-N-methyl-5-sulfamoylbenzamide
CID 65375226
5-(diethylcarbamoyl)-2,4-dimethoxybenzenesulfonyl chloride
CID 65368924
5-amino-N-ethyl-2-methoxy-N-methylbenzamide
CID 61094369
N-[2-(diethylamino)-2-oxoethyl]-2,4,5-trimethoxy-N-methylbenzamide
CID 31369496
2-[(2-methoxy-5-sulfamoylbenzoyl)-methylamino]acetic acid
CID 119171965
N-[(4-ethylphenyl)methyl]-2-methoxy-N-methyl-5-sulfamoylbenzamide
CID 7601402
2-methoxy-4,5-dimethylbenzenesulfonamide
CID 27241719
N-ethyl-2-methoxy-N-methyl-5-nitrobenzamide
CID 134005734
2-methyl-3-[methyl-(2,4,5-trimethoxybenzoyl)amino]propanoic acid
CID 119228595
N,N-diethyl-2-(4-methoxy-3-sulfamoylphenyl)acetamide
CID 65373612

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide?
The IUPAC name of N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide (CID 65375421) is N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide.
What is the SMILES notation for N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide?
The canonical SMILES for N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide is CCN(C)C(=O)c1cc(S(N)(=O)=O)c(OC)cc1OC.
What is the InChIKey of N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide?
The InChIKey is QEJMXCMBROVUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O5S/c1-5-14(2)12(15)8-6-11(20(13,16)17)10(19-4)7-9(8)18-3/h6-7H,5H2,1-4H3,(H2,13,16,17).
What are the key properties of N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide?
N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide has a molecular weight of 302.35 g/mol, XLogP of 0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide is sourced from PubChem (CID 65375421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).