N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide

C17H20N2O3S — CID 46635530

IUPACN,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
SMILESCc1ccccc1C(=O)N(C)C(C)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C17H20N2O3S/c1-12-6-4-5-7-16(12)17(20)19(3)13(2)14-8-10-15(11-9-14)23(18,21)22/h4-11,13H,1-3H3,(H2,18,21,22)
InChIKeyBROCBAXPEVTZRG-UHFFFAOYSA-N
MW332.43 g/mol
LogP2.48
Rot. Bonds4

About N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide

N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide (PubChem CID 46635530) has the molecular formula C17H20N2O3S and a molecular weight of 332.43 g/mol. Its IUPAC name is N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide.

Molecular Properties

Compound NameN,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
PubChem CID46635530
Molecular FormulaC17H20N2O3S
Molecular Weight332.43 g/mol
Exact Mass332.12
IUPAC NameN,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
SMILESCc1ccccc1C(=O)N(C)C(C)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C17H20N2O3S/c1-12-6-4-5-7-16(12)17(20)19(3)13(2)14-8-10-15(11-9-14)23(18,21)22/h4-11,13H,1-3H3,(H2,18,21,22)
InChIKeyBROCBAXPEVTZRG-UHFFFAOYSA-N
XLogP2.48
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.43
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,2-dimethyl-N-(1-phenylethyl)benzamide
CID 78799210
N,3-dimethyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide
CID 34734892
2,4-difluoro-N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
CID 46635547
N,4-dimethyl-3-pyrrol-1-yl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
CID 24612098
N-methyl-2-phenyl-N-[1-(4-sulfamoylphenyl)ethyl]pyrimidine-5-carboxamide
CID 86859015
N-methyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 51650990
4-iodo-N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
CID 42919716
3-bromo-N-methyl-N-[(1R)-1-(4-sulfamoylphenyl)ethyl]benzamide
CID 34735400
3-chloro-N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
CID 46635500
3,5-dimethoxy-N-methyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide
CID 51253856
(E)-N-methyl-3-phenyl-N-[1-(4-sulfamoylphenyl)ethyl]prop-2-enamide
CID 17480995
3-amino-N,2-dimethyl-3-phenyl-N-[1-(4-sulfamoylphenyl)ethyl]propanamide
CID 119689419

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide?
The IUPAC name of N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide (CID 46635530) is N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide.
What is the SMILES notation for N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide?
The canonical SMILES for N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide is Cc1ccccc1C(=O)N(C)C(C)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide?
The InChIKey is BROCBAXPEVTZRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3S/c1-12-6-4-5-7-16(12)17(20)19(3)13(2)14-8-10-15(11-9-14)23(18,21)22/h4-11,13H,1-3H3,(H2,18,21,22).
What are the key properties of N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide?
N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide has a molecular weight of 332.43 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N-[1-(4-sulfamoylphenyl)ethyl]benzamide is sourced from PubChem (CID 46635530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).