2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide

C11H16N2O5S — CID 65373113

IUPAC2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide
SMILESCOc1cc(OC)c(S(N)(=O)=O)cc1C(=O)N(C)C
InChIInChI=1S/C11H16N2O5S/c1-13(2)11(14)7-5-10(19(12,15)16)9(18-4)6-8(7)17-3/h5-6H,1-4H3,(H2,12,15,16)
InChIKeyJJRUAFYUOAILLH-UHFFFAOYSA-N
MW288.32 g/mol
LogP0.05
Rot. Bonds4

About 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide

2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide (PubChem CID 65373113) has the molecular formula C11H16N2O5S and a molecular weight of 288.32 g/mol. Its IUPAC name is 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide.

Molecular Properties

Compound Name2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide
PubChem CID65373113
Molecular FormulaC11H16N2O5S
Molecular Weight288.32 g/mol
Exact Mass288.08
IUPAC Name2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide
SMILESCOc1cc(OC)c(S(N)(=O)=O)cc1C(=O)N(C)C
InChIInChI=1S/C11H16N2O5S/c1-13(2)11(14)7-5-10(19(12,15)16)9(18-4)6-8(7)17-3/h5-6H,1-4H3,(H2,12,15,16)
InChIKeyJJRUAFYUOAILLH-UHFFFAOYSA-N
XLogP0.05
TPSA98.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2,4-dimethoxy-N-methyl-5-sulfamoylbenzamide
CID 65375421
methyl 2,4-dimethoxy-5-sulfamoylbenzoate
CID 63840880
2-methoxy-4,5-dimethylbenzenesulfonamide
CID 27241719
5-(diethylcarbamoyl)-2,4-dimethoxybenzenesulfonyl chloride
CID 65368924
5-[(E)-3-(4-chlorophenyl)prop-2-enoyl]-2,4-dimethoxybenzenesulfonamide
CID 171919657
4-tert-butyl-2-methoxy-N,N-dimethylbenzamide
CID 69030302
N,N,5-trimethyl-2-sulfamoylbenzamide
CID 65456580
5-fluoro-2-methoxy-N,N,4-trimethylbenzamide
CID 164883070
N,N-dimethyl-4-propan-2-yloxy-3-sulfamoylbenzamide
CID 65374064
5-chlorosulfonyl-2,4-dimethoxybenzoic acid
CID 16771362
2,4-bis(4-methoxyphenoxy)-5-sulfamoylbenzoic acid
CID 21487311
4-(dimethylcarbamoyl)-2-methoxybenzenesulfonyl chloride
CID 79770004

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide?
The IUPAC name of 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide (CID 65373113) is 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide.
What is the SMILES notation for 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide?
The canonical SMILES for 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide is COc1cc(OC)c(S(N)(=O)=O)cc1C(=O)N(C)C.
What is the InChIKey of 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide?
The InChIKey is JJRUAFYUOAILLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O5S/c1-13(2)11(14)7-5-10(19(12,15)16)9(18-4)6-8(7)17-3/h5-6H,1-4H3,(H2,12,15,16).
What are the key properties of 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide?
2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide has a molecular weight of 288.32 g/mol, XLogP of 0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-N,N-dimethyl-5-sulfamoylbenzamide is sourced from PubChem (CID 65373113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).